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Clofibrate glucuronide methyl ester TMS ether
SpectraBase Compound ID 1HuWcrYVH37
InChI InChI=1S/C26H45ClO9Si3/c1-26(2,33-18-15-13-17(27)14-16-18)25(29)32-24-22(36-39(10,11)12)20(35-38(7,8)9)19(34-37(4,5)6)21(31-24)23(28)30-3/h13-16,19-22,24H,1-12H3/t19-,20-,21-,22+,24-/m1/s1
InChIKey ZMLGLCCIRMEPNT-SWAMLEPWSA-N
Mol Weight 621.3 g/mol
Molecular Formula C26H45ClO9Si3
Exact Mass 620.20599 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID INjp6ahhrUA
Name Clofibrate glucuronide methyl ester TMS ether
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C26H45ClO9Si3
InChI InChI=1S/C26H45ClO9Si3/c1-26(2,33-18-15-13-17(27)14-16-18)25(29)32-24-22(36-39(10,11)12)20(35-38(7,8)9)19(34-37(4,5)6)21(31-24)23(28)30-3/h13-16,19-22,24H,1-12H3/t19-,20-,21-,22+,24-/m1/s1
InChIKey ZMLGLCCIRMEPNT-SWAMLEPWSA-N
Molecular Weight 621.345 g/mol
SMILES [C@@]1([C@]([C@](O[Si](C)(C)C)([C@](O[C@]1(C(=O)OC)[H])(OC(C(Oc1ccc(cc1)Cl)(C)C)=O)[H])[H])(O[Si](C)(C)C)[H])(O[Si](C)(C)C)[H]
SPLASH splash10-01b9-8935000000-0e83ca167c97c33d2a2d
Source of Spectrum CR-210-0-0
Synonyms Methyl 1-O-[2-(4-chlorophenoxy)-2-methylpropanoyl]-2,3,4-tris-O-(trimethylsilyl)-.beta.-L-glucopyranuronate
Wiley ID 1411510