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3beta-Hydroxy-5alpha-androst-1-en-17-one 2TMS
SpectraBase Compound ID DQVEEy16fQm
InChI InChI=1S/C25H44O2Si2/c1-24-15-13-19(26-28(3,4)5)17-18(24)9-10-20-21-11-12-23(27-29(6,7)8)25(21,2)16-14-22(20)24/h12-13,15,18-22H,9-11,14,16-17H2,1-8H3/t18-,19-,20?,21?,22?,24-,25-/m0/s1
InChIKey SFRPNIJYLWNJTG-ZYAYLLNKSA-N
Mol Weight 432.8 g/mol
Molecular Formula C25H44O2Si2
Exact Mass 432.287984 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2n967lRayAq
Name 3-beta-Hydroxy-5-alpha-androst-1-en-17-one 2TMS
Classification Designer steroid derivative
Comments Spectrum verified by independent measurements in external laboratories
Copyright Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 432.287983725 u
Formula C25H44O2Si2
InChI InChI=1S/C25H44O2Si2/c1-24-15-13-19(26-28(3,4)5)17-18(24)9-10-20-21-11-12-23(27-29(6,7)8)25(21,2)16-14-22(20)24/h12-13,15,18-22H,9-11,14,16-17H2,1-8H3/t18-,19-,20?,21?,22?,24-,25-/m0/s1
InChIKey SFRPNIJYLWNJTG-ZYAYLLNKSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 432.795 g/mol
Nominal Mass 432 u
Quality 942
Retention Index 2632
SMILES [C@@]12([C@](C[C@](C=C2)(O[Si](C)(C)C)[H])(CCC2C1CC[C@]1(C2CC=C1O[Si](C)(C)C)C)[H])C
SPLASH splash10-01e9-8961800000-0b16dc730df7507e0826
Source of Spectrum DigiLab GmbH (C) 2024
Synonyms 3beta-Hydroxy-5alpha-androst-1-en-17-one 2TMS (((5aS,7R,9aR,11aS)-9a,11a-dimethyl-1-((trimethylsilyl)oxy)-3a,3b,4,5,5a,6,7,9a,9b,10,11,11a-\rdodecahydro-3H-cyclopenta[a]phenanthren-7-yl)oxy)(trimethyl)silane
Technique GC/MS
Wiley ID DD2024_011563