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

*Links on SpectraBase are not permalinks.

4-oxa-5.alpha.-Androstane-3,17-dione

View entire compound with spectra: 1 FTIR

4-oxa-5.alpha.-Androstane-3,17-dione
SpectraBase Compound ID JMPGQ14Yh13
InChI InChI=1S/C18H26O3/c1-17-9-7-13-11(12(17)4-5-14(17)19)3-6-15-18(13,2)10-8-16(20)21-15/h11-13,15H,3-10H2,1-2H3/t11-,12-,13-,15+,17-,18+/m0/s1
InChIKey MXDPQMQGOXWUBC-GEDVFAKWSA-N
Mol Weight 290.4 g/mol
Molecular Formula C18H26O3
Exact Mass 290.188195 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

View the Full Spectrum for FREE!

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

SpectraBase Spectrum ID LrP4VTjw4qV
Name 4-oxa-5.alpha.-Androstane-3,17-dione
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 290.188194694 u
Formula C18H26O3
InChI InChI=1S/C18H26O3/c1-17-9-7-13-11(12(17)4-5-14(17)19)3-6-15-18(13,2)10-8-16(20)21-15/h11-13,15H,3-10H2,1-2H3/t11-,12-,13-,15+,17-,18+/m0/s1
InChIKey MXDPQMQGOXWUBC-GEDVFAKWSA-N
SMILES C1(CC[C@]2([C@](O1)(CC[C@@]1([C@@]2(CC[C@]2([C@]1(CCC2=O)[H])C)[H])[H])[H])C)=O
Spectrum/Structure Validation Score (Vapor Phase IR) 0.975244