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

*Links on SpectraBase are not permalinks.

3Alpha-hydroxy-6alpha-methylandrost-4-en-17-one

View entire compound with spectra: 1 NMR, 1 FTIR, and 1 MS (GC)

3Alpha-hydroxy-6alpha-methylandrost-4-en-17-one
SpectraBase Compound ID EScTupGbtLX
InChI InChI=1S/C20H30O2/c1-12-10-14-15-4-5-18(22)20(15,3)9-7-16(14)19(2)8-6-13(21)11-17(12)19/h11-16,21H,4-10H2,1-3H3/t12-,13+,14-,15-,16-,19+,20-/m0/s1
InChIKey NHJDSHABXIUJHA-LJVJIRBISA-N
Mol Weight 302.46 g/mol
Molecular Formula C20H30O2
Exact Mass 302.22458 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

Subscribe to view the full spectrum.

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

SpectraBase Spectrum ID HmpPqnMtDi0
Name 3Alpha-hydroxy-6alpha-methylandrost-4-en-17-one
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 302.224580204 u
Formula C20H30O2
InChI InChI=1S/C20H30O2/c1-12-10-14-15-4-5-18(22)20(15,3)9-7-16(14)19(2)8-6-13(21)11-17(12)19/h11-16,21H,4-10H2,1-3H3/t12-,13+,14-,15-,16-,19+,20-/m0/s1
InChIKey NHJDSHABXIUJHA-LJVJIRBISA-N
SMILES C1C[C@]2(C(=C[C@@]1(O)[H])[C@](C[C@@]1([C@@]2(CC[C@]2([C@]1(CCC2=O)[H])C)[H])[H])(C)[H])C
Spectrum/Structure Validation Score (Vapor Phase IR) 0.968732