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3.alpha.-Bromoandroster-17-one

View entire compound with spectra: 1 MS (GC)

3.alpha.-Bromoandroster-17-one
SpectraBase Compound ID dHaDtA3e2o
InChI InChI=1S/C19H29BrO/c1-18-9-7-13(20)11-12(18)3-4-14-15-5-6-17(21)19(15,2)10-8-16(14)18/h12-16H,3-11H2,1-2H3/t12?,13-,14+,15+,16+,18+,19+/m1/s1
InChIKey VTCZBZSTRGDAOO-YROQGIJISA-N
Mol Weight 353.34 g/mol
Molecular Formula C19H29BrO
Exact Mass 352.140179 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GMXtDw4w4ZP
Name 3.alpha.-Bromoandroster-17-one
Alternate Name(s) 3.alpha.-Bromoandrostane-17-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H29BrO
InChI InChI=1S/C19H29BrO/c1-18-9-7-13(20)11-12(18)3-4-14-15-5-6-17(21)19(15,2)10-8-16(14)18/h12-16H,3-11H2,1-2H3/t12?,13-,14+,15+,16+,18+,19+/m1/s1
InChIKey VTCZBZSTRGDAOO-YROQGIJISA-N
Molecular Weight 353.344 g/mol
SMILES [C@@]12([C@@]3([C@@]([C@@]4(CCC([C@]4(CC3)C)=O)[H])([H])CCC2C[C@@](CC1)(Br)[H])[H])C
SPLASH splash10-0udi-3129000000-a017c9c82e0584aacb3c
Source of Spectrum F-56-4182-35
Wiley ID 857365