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Campesterol TMS
SpectraBase Compound ID 9a8USGbldoN
InChI InChI=1S/C31H56OSi/c1-21(2)22(3)10-11-23(4)27-14-15-28-26-13-12-24-20-25(32-33(7,8)9)16-18-30(24,5)29(26)17-19-31(27,28)6/h12,21-23,25-29H,10-11,13-20H2,1-9H3/t22-,23-,25+,26?,27-,28+,29+,30+,31-/m1/s1
InChIKey VWYCDHUXOZENHE-MSFHIMRFSA-N
Mol Weight 472.9 g/mol
Molecular Formula C31H56OSi
Exact Mass 472.410043 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DlqlkXaiEjY
Name Campesterol TMS
CAS Registry Number 55429-62-4
Classification Phytosterol derivative
Copyright Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 472.410042957 u
Formula C31H56OSi
InChI InChI=1S/C31H56OSi/c1-21(2)22(3)10-11-23(4)27-14-15-28-26-13-12-24-20-25(32-33(7,8)9)16-18-30(24,5)29(26)17-19-31(27,28)6/h12,21-23,25-29H,10-11,13-20H2,1-9H3/t22-,23-,25+,26?,27-,28+,29+,30+,31-/m1/s1
InChIKey VWYCDHUXOZENHE-MSFHIMRFSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 472.873 g/mol
Nominal Mass 472 u
Quality 965
Retention Index 3471
SMILES [C@]12([C@@]([C@](CC2)([C@@](CC[C@](C(C)C)(C)[H])(C)[H])[H])(CC[C@]2(C1CC=C1[C@@]2(CC[C@@](C1)(O[Si](C)(C)C)[H])C)[H])C)[H]
SPLASH splash10-00bc-5912000000-0446fc27ba21db51e669
Source of Spectrum DigiLab GmbH (C) 2024
Synonyms (((1R,3aS,7S,9aR,9bS,11aR)-1-((2R,5R)-5,6-dimethylheptan-2-yl)-9a,11a-dimethyl-2,3,3a,3b,4,6,\r7,8,9,9a,9b,10,11,11a-tetradecahydro-1H-cyclopenta[a]phenanthren-7-yl)oxy)(trimethyl)silane
Technique GC/MS
Wiley ID DD2024_026128