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5-alpha-Androst-1-en-3,17-dione 2TMS
SpectraBase Compound ID 2NFScjS8QJz
InChI InChI=1S/C25H42O2Si2/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/h12-13,15,17-18,20-22H,9-11,14,16H2,1-8H3/t18-,20-,21-,22-,24-,25-/m0/s1
InChIKey ZFBDRIJKKXGAOU-BYZHJWIBSA-N
Mol Weight 430.8 g/mol
Molecular Formula C25H42O2Si2
Exact Mass 430.272334 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GXaZGMOenwm
Name 5-alpha-Androst-1-en-3,17-dione 2TMS
Classification Pharmaceutical drug derivative
Comments Spectrum verified by independent measurements in external laboratories
Copyright Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 430.272333660 u
Formula C25H42O2Si2
InChI InChI=1S/C25H42O2Si2/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/h12-13,15,17-18,20-22H,9-11,14,16H2,1-8H3/t18-,20-,21-,22-,24-,25-/m0/s1
InChIKey ZFBDRIJKKXGAOU-BYZHJWIBSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 430.779 g/mol
Nominal Mass 430 u
Quality 920
Retention Index 3279
SMILES [C@]12([C@@]([C@@]3([C@@](CC2)(C=C(C=C3)O[Si](C)(C)C)[H])C)(CC[C@]2([C@]1(CC=C2O[Si](C)(C)C)[H])C)[H])[H]
SPLASH splash10-01b9-6941700000-56402be0ae084762a124
Source of Spectrum DigiLab GmbH (C) 2024
Synonyms 1-Androstendione 2TMS (((3aS,3bR,5aS,9aR,9bS,11aS)-9a,11a-dimethyl-1-((trimethylsilyl)oxy)-3a,3b,4,5,5a,9a,9b,10,11,\r11a-decahydro-3H-cyclopenta[a]phenanthren-7-yl)oxy)(trimethyl)silane
Technique GC/MS
Wiley ID DD2024_011562