For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
3-Oxo-5.beta.-androstan-16.beta.-yl acetate
SpectraBase Compound ID 9NhnmNDIvj1
InChI InChI=1S/C21H32O3/c1-13(22)24-16-11-19-17-5-4-14-10-15(23)6-9-21(14,3)18(17)7-8-20(19,2)12-16/h14,16-19H,4-12H2,1-3H3/t14-,16+,17-,18+,19+,20-,21+/m1/s1
InChIKey IIDHKRVWBVQTLF-PATVUPGHSA-N
Mol Weight 332.5 g/mol
Molecular Formula C21H32O3
Exact Mass 332.235145 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID DvMGFTEsj2h
Name 3-Oxo-5.beta.-androstan-16.beta.-yl acetate
Alternate Name(s) (5beta,16beta)-3-oxoandrostan-16-yl acetate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H32O3
InChI InChI=1S/C21H32O3/c1-13(22)24-16-11-19-17-5-4-14-10-15(23)6-9-21(14,3)18(17)7-8-20(19,2)12-16/h14,16-19H,4-12H2,1-3H3/t14-,16+,17-,18+,19+,20-,21+/m1/s1
InChIKey IIDHKRVWBVQTLF-PATVUPGHSA-N
Molecular Weight 332.484 g/mol
SMILES [C@@]12([C@@]3([C@@]([C@@]4(C[C@](OC(=O)C)(C[C@]4(CC3)C)[H])[H])([H])CC[C@@]2(CC(CC1)=O)[H])[H])C
SPLASH splash10-0a4i-9180000000-1f70371026f9b2eeafba
Source of Spectrum KC-1991-1829-0
Wiley ID 1329841