|
Sample | Ganoderma | RT | m/z | Mass | Name | Molecular formula |
|
T1 | (−) | 0.87 | 175.119 | 174.112 | Arginine | C6 H14 N4 O2 |
T1 | (−) | 0.92 | 104.107 | 103.1 | 2-Amino-3-methyl-1-butanol | C5 H13 N O |
T1 | (−) | 1 | 293.066 | 254.101 | Dyphylline | C10 H14 N4 O4 |
T1 | (−) | 1.01 | 203.054 | 180.065 | Theobromine | C7 H8 N4 O2 |
T1 | (−) | 1.02 | 435.062 | 180.065 | 4-Hydroxylevamisole glucuronide | C17 H20 N2 O7 S |
T1 | (−) | 1.13 | 220.134 | 180.065 | Meperidinic acid | C13 H17 N O2 |
T1 | (−) | 1.2 | 268.155 | 180.065 | Metoprolol acid | C14 H21 N O4 |
T1 | (−) | 1.24 | 206.119 | 180.065 | Normeperidinic acid | C12 H15 N O2 |
T1 | (−) | 1.25 | 282.171 | 180.065 | Benzenepropanoic acid, 4-[2-hydroxy-3- | C15 H23 N O4 |
[(1-methylethyl)amino]propoxy]-(9CI) ASL 8123 |
T1 | (−) | 1.93 | 417.18 | 180.065 | S-adenosylmethionine | C15 H23 N6 O5 S |
T1 | (−) | 1.96 | 362.209 | 180.065 | Phe Pro Val | C19 H27 N3 O4 |
T1 | (−) | 2.18 | 234.15 | 180.065 | Normeperidine | C14 H19 N O2 |
T1 | (−) | 2.23 | 409.185 | 180.065 | Asn Met Gln | C14 H25 N5 O6 S |
T1 | (−) | 2.31` | 409.185 | 180.065 | Asn Met Gln | C14 H25 N5 O6 S |
T1 | (−) | 2.89 | 480.226 | 180.065 | Gln Phe Trp | C25 H29 N5 O5 |
T1 | (−) | 3.17 | 236.166 | 180.065 | 5,7,9,11,13-tetradecapentaenoic acid | C14 H18 O2 |
T1 | (-) | 3.23 | 480.224 | 180.065 | Gln Phe Trp | C25 H29 N5 O5 |
T1 | (−) | 3.47 | 601.154 | 180.065 | Rhoifolin | C27 H30 O14 |
T1 | (−) | 4.71 | 393.19 | 180.065 | Trp Gly Asn | C17 H21 N5 O5 |
T1 | (−) | 4.89 | 541.263 | 180.065 | 17-Alpha, 21-dihydroxy-11,20-dioxo-5-beta-pregnan- | C27 H40 O11 |
3-alpha-yl-beta-d-glucuronide |
T1 | (−) | 5.26 | 395.205 | 180.065 | Tyr Gly Arg | C17 H26 N6 O5 |
T1 | (−) | 9.75 | 246.243 | 180.065 | 4,8-Dimethyl-dodecanoic acid | C14 H28 O2 |
T1 | (−) | 12.1 | 274.275 | 180.065 | C16 sphinganine | C16 H35 N O2 |
T1 | (−) | 12.1 | 274.275 | 180.065 | C16 sphinganine | C16 H35 N O2 |
T1 | (−) | 12.2 | 230.249 | 180.065 | Myristaldehyde | C14 H28 O |
T1 | (−) | 12.2 | 318.301 | 180.065 | Phytosphingosine | C18 H39 N O3 |
T1 | (−) | 12.2 | 288.291 | 180.065 | C17 sphinganine | C17 H37 N O2 |
T1 | (−) | 12.4 | 288.291 | 180.065 | C17 sphinganine | C17 H37 N O2 |
T1 | (−) | 12.6 | 272.259 | 180.065 | 2R-aminohexadecanoic acid | C16 H33 N O2 |
T1 | (−) | 12.8 | 288.291 | 180.065 | C17 Sphinganine | C17 H37 N O2 |
T1 | (−) | 13.2 | 288.291 | 180.065 | C17 Sphinganine | C17 H37 N O2 |
T1 | (−) | 13.3 | 244.265 | 180.065 | 9-Pentadecen-1-ol | C15 H30 O |
T1 | (−) | 15 | 272.296 | 180.065 | 14-Methyl-8-hexadecen-1-ol | C17 H34 O |
T1 | (−) | 15.5 | 272.296 | 180.065 | 14-Methyl-8-hexadecen-1-ol | C17 H34 O |
T1 | (−) | 16.2 | 599.412 | 180.065 | Mytiloxanthin | C40 H54 O4 |
T1 | (−) | 21.3 | 599.412 | 180.065 | Mytiloxanthin | C40 H54 O4 |
T1 | (−) | 21.5 | 585.433 | 180.065 | Myxol | C40 H56 O3 |
T1 | (−) | 21.5 | 601.427 | 180.065 | Capsanthin 3,6-epoxide | C40 H56 O4 |
T1 | (−) | 21.8 | 429.374 | 180.065 | 25-Hydroxy-26,27-dimethylvitamin D3/ | C29 H48 O2 |
25-Hydroxy-26,27-dimethylcholecalciferol |
T1 | (−) | 22.1 | 167.01 | 180.065 | 6-Hydroxy-2-hexynoic acid | C6 H8 O3 |
T1 | (+) | 8.79 | 213.145 | 180.065 | meglumine | C7 H17 N O5 |
T1 | (+) | 17.8 | 248.198 | 180.065 | Leu Val | C11 H22 N2 O3 |
T1 | (+) | 17.8 | 192.135 | 180.065 | Lupinine | C10 H19 N O |
T2 | (−) | 21.92 | 125.039 | 248.064 | Asp Asp | C8 H12 N2 O7 |
T2 | (+) | 1.06 | 300.148 | 299.14 | Metoclopramide | C14 H22 Cl N3 O2 |
T2 | (+) | 1.17 | 300.148 | 299.141 | Metoclopramide | C14 H22 Cl N3 O2 |
T2 | (+) | 2.28 | 409.187 | 408.18 | Trp Phe Gly | C22 H24 N4 O4 |
T2 | (+) | 5.24 | 395.208 | 356.246 | Dopexamine | C22 H32 N2 O2 |
T2 | (+) | 17.77 | 243.139 | 242.132 | 6E,8E,14E-hexadecatriene-10,12-diynoic acid | C16 H18 O2 |
T3 | (−) | 22.09 | 102.971 | 64.0082 | Ethyl chloride | C2 H5 Cl |
T3 | (+) | 0.26 | 257.975 | 219.011 | 4-Amino-3-(5-chlorothien-2-YL) Butanoic acid | C8 H10 Cl N O2 S |
T3 | (+) | 0.97 | 293.066 | 254.103 | Dyphylline | C10 H14 N4 O4 |
T3 | (+) | 0.98 | 219.028 | 180.065 | Theobromine | C7 H8 N4 O2 |
T3 | (+) | 1 | 277.0914 | 254.102 | Dyphylline | C10 H14 N4 O4 |
T3 | (+) | 1.01 | 203.055 | 180.065 | Theobromine | C7 H8 N4 O2 |
T3 | (+) | 1.03 | 435.061 | 396.097 | 4-Hydroxylevamisole glucuronide | C17 H20 N2 O7 S |
T3 | (+) | 2 | 362.244 | 344.21 | Oxyphencyclimine | C20 H28 N2 O3 |
T3 | (+) | 2.27 | 409.187 | 408.18 | Trp Phe Gly | C22 H24 N4 O4 |
T3 | (+) | 2.9 | 480.227 | 479.219 | Gln Phe Trp | C25 H29 N5 O5 |
T3 | (+) | 3.24 | 480.226 | 479.219 | Gln Phe Trp | C25 H29 N5 O5 |
T3 | (+) | 3.63 | 264.161 | 246.127 | Santonin | C15 H18 O3 |
T3 | (+) | 5.26 | 395.207 | 377.174 | Gln Lys Cys | C14 H27 N5 O5 S |
T3 | (+) | 12.07 | 274.275 | 273.268 | C16 Sphinganine | C16 H35 N O2 |
T3 | (+) | 12.49 | 409.16 | 370.197 | Lys His Ser | C15 H26 N6 O5 |
T3 | (+) | 16 | 243.134 | 242.126 | Hydroxyamobarbital | C11 H18 N2 O4 |
T3 | (+) | 18.2 | 419.243 | 418.236 | Met Arg Leu | C17 H34 N6 O4 S |
T3 | (+) | 18.22 | 419.279 | 418.272 | Simvastatin | C25 H38 O5 |
T3 | (+) | 18.23 | 375.253 | 374.245 | Digitoxigenin | C23 H34 O4 |
T4 | (−) | 16.01 | 243.133 | 242.126 | Hydroxyamobarbital | C11 H18 N2 O4 |
T4 | (+) | 0.99 | 277.091 | 254.102 | Dyphylline | C10 H14 N4 O4 |
T4 | (+) | 1.01 | 138.058 | 120.025 | Sulfolane | C4 H8 O2 S |
T4 | (+) | 1.95 | 362.243 | 344.209 | Oxyphencyclimine | C20 H28 N2 O3 |
T4 | (+) | 2.25 | 409.186 | 408.178 | Trp Phe Gly | C22 H24 N4 O4 |
T4 | (+) | 2.86 | 480.226 | 479.218 | Gln Phe Trp | C25 H29 N5 O5 |
T4 | (+) | 3.2 | 480.226 | 479.219 | Gln Phe Trp | C25 H29 N5 O5 |
T4 | (+) | 3.44 | 601.156 | 578.166 | Rhoifolin | C27 H30 O14 |
T4 | (+) | 5.23 | 395.207 | 377.173 | Gln Lys Cys | C14 H27 N5 O5 S |
T4 | (+) | 12.06 | 274.275 | 273.268 | C16 sphinganine | C16 H35 N O2 |
T4 | (+) | 12.18 | 318.3 | 317.292 | Phytosphingosine | C18 H39 N O3 |
T4 | (+) | 12.48 | 409.163 | 386.174 | Lys Cys His | C15 H26 N6 O4 S |
T4 | (+) | 18.19 | 419.279 | 418.271 | Simvastatin | C25 H38 O5 |
T4 | (+) | 21.49 | 585.433 | 584.426 | Myxol | C40 H56 O3 |
T5 | (-) | 22.61 | 179.988 | 141.025 | 5-Acetyl-4-methylthiazole | C6 H7 N O S |
T5 | (−) | 22.93 | ― | 141.025 | 5-Acetyl-4-methylthiazole | C6 H7 N O S |
T5 | (+) | 1.35 | 167.01 | 128.047 | 6-Hydroxy-2-hexynoic acid | C6 H8 O3 |
T5 | (+) | 17.76 | 248.196 | 230.162 | Leu Val | C11 H22 N2 O3 |
T5 | (+) | 17.77 | 192.136 | 169.147 | Lupinine | C10 H19 N O |
T5 | (+) | 21.45 | 411.2875 | 410.2796 | 24,25-epoxy-1 alpha-hydroxy-22,22 | C27 H38 O3 |
T5 | (+) | 21.46 | 343.2247 | 320.2348 | (+/−)14,15-EpETrE | C20 H32 O3 |
T5 | (+) | 21.48 | 479.3497 | 456.3595 | Testosterone undecanoate | C30 H48 O3 |
T5 | (+) | 21.65 | 343.2245 | 320.2353 | (+/−)14,15-EpETrE | C20 H32 O3 |
T5 | (+) | 21.66 | 411.2861 | 388.297 | 1α,25-Dihydroxy-23,24-dinorvitamin D3 | C25 H40 O3 |
T5 | (+) | 21.94 | 125.0381 | 248.0616 | Dapsone | C12 H12 N2 O2 S |
T6 | (−) | 17.77 | 248.1973 | 230.1635 | Leu Val | C11 H22 N2 O3 |
T6 | (−) | 17.78 | 243.1331 | 242.1258 | Hydroxyamobarbital | C11 H18 N2 O4 |
T6 | (−) | 21.56 | 839.4909 | 821.4566 | Tacrolimus metabolite M-VIII | C43 H67 N O14 |
T6 | (−) | 21.65 | 498.9004 | 497.8933 | Perflubron | C8 Br F17 |
T6 | (+) | 21.66 | 498.9008 | 497.8937 | Perflubron | C8 Br F17 |
T6 | (+) | 21.95 | 125.0378 | 248.0611 | Dapsone | C12 H12 N2 O2 S |
T7 | (−) | 1.2 | 179.9883 | 141.0251 | 5-Acetyl-4-methylthiazole | C6 H7 N O S |
T7 | (−) | 17.77 | 248.1964 | 230.1627 | Leu Val | C11 H22 N2 O3 |
T7 | (−) | 21.65 | 498.9009 | 497.8938 | Perflubron | C8 Br F17 |
T7 | (+) | 17.51 | 301.1413 | 278.152 | Phthalic acid mono-2-ethylhexyl Ester | C16 H22 O4 |
T7 | (+) | 17.77 | 192.1362 | 169.1473 | Lupinine | C10 H19 N O |
T7 | (+) | 17.77 | 248.2013 | 247.194 | Lycopodine | C16 H25 N O |
T7 | (+) | 20.14 | 282.2793 | 281.2721 | Oleoyl amine | C18 H35 N O |
T7 | (+) | 21.44 | 411.2876 | 388.298 | 1α-hydroxy-21-nor-20-oxavitamin D3 | C25 H40 O3 |
T7 | (+) | 21.45 | 343.2242 | 320.235 | (+/−)14,15-EpETrE | C20 H32 O3 |
T7 | (+) | 21.62 | 343.224 | 320.2347 | (+/−)14,15-EpETrE | C20 H32 O3 |
T7 | (+) | 21.64 | 411.2862 | 388.297 | 1α,25-Dihydroxy-23,24-dinorvitamin D3 | C25 H40 O3 |
T7 | (+) | 22.15 | 167.011 | 128.0479 | 6-Hydroxy-2-hexynoic acid | C6 H8 O3 |
T7 | (+) | 22.74 | 179.9885 | 141.0251 | 5-Acetyl-4-methylthiazole | C6 H7 N O S |
T8 | (−) | 16.01 | 243.1334 | 242.1261 | Hydroxyamobarbital | C11 H18 N2 O4 |
T8 | (−) | 17.77 | 243.1333 | 242.126 | Hydroxyamobarbital | C11 H18 N2 O4 |
T8 | (+) | 17.76 | 248.1967 | 230.1631 | Leu Val | C11 H22 N2 O3 |
T8 | (+) | 17.77 | 192.1347 | 174.1013 | Val Gly | C7 H14 N2 O3 |
T8 | (+) | 21.61 | 395.2916 | 356.3286 | (+)-3-hydroxy behenic | C22 H44 O3 |
T8 | (+) | 21.67 | 909.5463 | 886.5559 | Glc-GP(18:0/20:4(5Z,8Z,11Z,14Z)) | C47 H83 O13 P |
T8 | (+) | 21.93 | 125.0388 | 248.0632 | Dapsone | C12 H12 N2 O2 S |
T9 | (−) | 0.92 | 104.1065 | 103.0992 | 2-Amino-3-methyl-1-butanol | C5 H13 N O |
T9 | (−) | 0.97 | 176.0109 | 137.0479 | p-aminobenzoic acid | C7 H7 N O2 |
T9 | (−) | 0.98 | 293.0644 | 254.1012 | Dyphylline | C10 H14 N4 O4 |
T9 | (−) | 0.99 | 160.0375 | 137.0483 | 3-Pyridylacetic acid | C7 H7 N O2 |
T9 | (−) | 1.02 | 203.0545 | 180.0654 | Theobromine | C7 H8 N4 O2 |
T9 | (−) | 1.03 | 435.0635 | 396.0998 | 4-Hydroxylevamisole glucuronide | C17 H20 N2 O7 S |
T9 | (−) | 1.05 | 265.0252 | 226.0621 | Anthralin | C14 H10 O3 |
T9 | (−) | 1.13 | 230.0935 | 191.1302 | Diethyltoluamide | C12 H17 N O |
T9 | (−) | 1.19 | 287.1111 | 264.122 | 1-(5-Ketohexyl)-3-methylxanthine | C12 H16 N4 O3 |
T9 | (−) | 1.21 | 268.1553 | 267.1479 | Metoprolol acid | C14 H21 N O4 |
T9 | (−) | 1.26 | 282.1712 | 281.1639 | Benzenepropanoic acid | C15 H23 N O4 |
T9 | (−) | 1.98 | 362.2078 | 361.2005 | Phe Val Pro | C19 H27 N3 O4 |
T9 | (−) | 2.03 | 362.242 | 344.2085 | Oxyphencyclimine | C20 H28 N2 O3 |
T9 | (−) | 2.28 | 411.2 | 388.2101 | Methyl 10,12,13,15-bisepidioxy- | C19 H32 O8 |
16-Hydroperoxy-8E-octadecenoate |
T9 | (−) | 2.28 | 409.185 | 391.1507 | Asn Met Gln | C14 H25 N5 O6 S |
T9 | (−) | 2.45 | 621.217 | 620.2091 | Diethylstilbestrol diglucuronide | C30 H36 O14 |
T9 | (−) | 2.89 | 480.225 | 479.2173 | Gln Phe Trp | C25 H29 N5 O5 |
T9 | (−) | 3.23 | 480.225 | 479.2173 | Gln Phe Trp | C25 H29 N5 O5 |
T9 | (−) | 3.5 | 601.155 | 578.1652 | Rhoifolin | C27 H30 O14 |
T9 | (−) | 5.2 | 395.174 | 377.1404 | Ofloxacin-N-oxide | C18 H20 F N3 O5 |
T9 | (−) | 5.26 | 395.206 | 377.1723 | Gln Lys Cys | C14 H27 N5 O5 S |
T9 | (−) | 5.69 | 205.062 | 182.0728 | 9-Hydroxyfluorene | C13 H10 O |
T9 | (−) | 12.06 | 274.275 | 273.2672 | C16 sphinganine | C16 H35 N O2 |
T9 | (−) | 12.19 | 318.3 | 317.2924 | Phytosphingosine | C18 H39 N O3 |
T9 | (−) | 12.49 | 409.13 | 408.1232 | Ichthynone | C23 H20 O7 |
T9 | (−) | 16.17 | 599.411 | 598.4032 | Mytiloxanthin | C40 H54 O4 |
T9 | (−) | 20.08 | 797.52 | 774.5304 | 1,2 di-(9Z,12Z,15Z-octadecatrienoyl)-3- | C45 H74 O10 |
O-beta-D-galactosyl-sn-glycerol |
T9 | (−) | 21.5 | 585.433 | 584.425 | Myxol | C40 H56 O3 |
T9 | (−) | 21.5 | 601.427 | 600.4195 | Capsanthin 3,6-epoxide | C40 H56 O4 |
T9 | (−) | 21.69 | 646.254 | 645.2443 | Acarbose (Glucobay) | C25 H43 N O18 |
T9 | (−) | 21.49 | 607.29 | 568.3266 | (3a,5b,7a)-23-carboxy-7-hydroxy-24-norcholan-3-yl, | C30 H48 O10 |
b-D-glucopyranosiduronic acid |
T10 | (−) | 0.97 | 293.065 | 254.1022 | Dyphylline | C10 H14 N4 O4 |
T10 | (−) | 1.03 | 265.025 | 226.0623 | Anthralin | C14 H10 O3 |
T10 | (−) | 1.17 | 287.112 | 264.1228 | 1-(5-Ketohexyl)-3-methylxanthine | C12 H16 N4 O3 |
T10 | (−) | 2 | 362.243 | 344.2091 | Oxyphencyclimine | C20 H28 N2 O3 |
T10 | (−) | 2.29 | 411.2 | 410.1925 | Flumethasone | C22 H28 F2 O5 |
T10 | (−) | 2.29 | 409.185 | 408.1781 | Trp Phe Gly | C22 H24 N4 O4 |
T10 | (−) | 2.45 | 621.218 | 620.2108 | Diethylstilbestrol diglucuronide | C30 H36 O14 |
T10 | (−) | 2.92 | 480.225 | 479.2179 | Gln Phe Trp | C25 H29 N5 O5 |
T10 | (−) | 3.25 | 480.225 | 479.2187 | Gln Phe Trp | C25 H29 N5 O5 |
T10 | (−) | 3.64 | 264.159 | 246.1251 | Santonin | C15 H18 O3 |
T10 | (−) | 5.23 | 395.207 | 377.1738 | Gln Cys Lys | C14 H27 N5 O5 S |
T10 | (−) | 12.19 | 318.302 | 317.2943 | Phytosphingosine | C18 H39 N O3 |
T10 | (−) | 12.72 | 288.291 | 287.2833 | C17 sphinganine | C17 H37 N O2 |
T10 | (−) | 13.14 | 288.29 | 287.2824 | C17 sphinganine | C17 H37 N O2 |
T10 | (−) | 14.93 | 316.321 | 298.2873 | 11-Methyl-octadecanoic acid | C19 H38 O2 |
T10 | (−) | 14.97 | 272.295 | 254.2608 | 14-Methyl-8-hexadecen-1-ol | C17 H34 O |
T10 | (−) | 15.51 | 304.286 | 286.2515 | 17-Hydroxy-heptadecanoic acid | C17 H34 O3 |
T10 | (−) | 16.17 | 599.409 | 598.4011 | Mytiloxanthin | C40 H54 O4 |
T10 | (−) | 17.76 | 248.197 | 230.1627 | Leu Val | C11 H22 N2 O3 |
T10 | (−) | 21.31 | 597.238 | 574.2481 | p-hydroxy atorvastatin | C33 H35 F N2 O6 |
T10 | (−) | 21.48 | 585.433 | 584.4252 | Myxol | C40 H56 O3 |
T10 | (−) | 21.63 | 607.287 | 568.3253 | (3a,5b,7a)-23-carboxy-7-hydroxy-24-norcholan-3-yl, | C30 H48 O10 |
b-D-Glucopyranosiduronic acid |
T10 | (−) | 21.69 | 469.368 | 468.36 | 1α,25-Dihydroxy-26,27-dimethyl-22,22,23,23- | C31 H48 O3 |
tetradehydro-24a,24b-dihomovitamin D3 |
T10 | (−) | 21.76 | 469.368 | 468.357 | 1α,25-Dihydroxy-26,27-dimethyl-22,22,23,23 | C31 H48 O3 |
-tetradehydro-24a,24b-dihomovitamin D3 |
T10 | (−) | 21.77 | 429.375 | 428.367 | 25-hydroxy-26,27-dimethylvitamin D3/ | C29 H48 O2 |
25-hydroxy-26,27-dimethylcholecalciferol |
T10 | (−) | 22.48 | 607.287 | 606.277 | Trandolapril glucuronide | C30 H42 N2 O11 |
T10 | (+) | 1.04 | 265.027 | 226.064 | Anthralin | C14 H10 O3 |
T10 | (+) | 1.07 | 300.148 | 299.141 | Metoclopramide | C14 H22 Cl N3 O2 |
T10 | (+) | 1.17 | 300.147 | 299.14 | Metoclopramide | C14 H22 Cl N3 O2 |
T10 | (+) | 1.98 | 362.245 | 344.211 | Oxyphencyclimine | C20 H28 N2 O3 |
T10 | (+) | 2.27 | 409.187 | 408.18 | Trp Phe Gly | C22 H24 N4 O4 |
T10 | (+) | 5.22 | 395.208 | 377.175 | Gln Cys Lys | C14 H27 N5 O5 S |
T10 | (+) | 11.98 | 274.254 | 273.246 | 10Z,13Z,16Z-nonadecatrienenitrile | C19 H31 N |
T10 | (+) | 12.15 | 230.248 | 212.214 | Myristaldehyde | C14 H28 O |
T10 | (+) | 12.17 | 318.3 | 317.293 | Phytosphingosine | C18 H39 N O3 |
T10 | (+) | 17.76 | 243.139 | 242.131 | 6E,8E,14E-Hexadecatriene-10,12-diynoic acid | C16 H18 O2 |
T10 | (+) | 17.87 | 243.138 | 242.131 | 6E,8E,14E-Hexadecatriene-10,12-diynoic acid | C16 H18 O2 |
T10 | (+) | 18.22 | 419.281 | 418.273 | Simvastatin | C25 H38 O5 |
T10 | (+) | 21.29 | 645.275 | 606.312 | 1,25-Dihydroxy-20S-21-(3-hydroxy-3-methylbutyl) | C32 H44 F6 O4 |
-23-yne-26,27-hexafluorovitamin D3 |
T10 | (+) | 21.7 | 646.258 | 645.249 | Acarbose (Glucobay) | C25 H43 N O18 |
|