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

*Links on SpectraBase are not permalinks.

4,4-Dimethyl-3-oxoandrost-5-en-17-yl acetate

View entire compound with spectra: 1 NMR, 1 FTIR, and 2 MS (GC)

4,4-Dimethyl-3-oxoandrost-5-en-17-yl acetate
SpectraBase Compound ID 1Zwume1hqN9
InChI InChI=1S/C23H34O3/c1-14(24)26-20-9-7-16-15-6-8-18-21(2,3)19(25)11-13-22(18,4)17(15)10-12-23(16,20)5/h8,15-17,20H,6-7,9-13H2,1-5H3
InChIKey RSQJEZDDLITPIW-UHFFFAOYSA-N
Mol Weight 358.5 g/mol
Molecular Formula C23H34O3
Exact Mass 358.250795 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

View the Full Spectrum for FREE!

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

SpectraBase Spectrum ID BAYwseIyitr
Name 4,4-Dimethyl-3-oxoandrost-5-en-17-yl acetate
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 358.250794952 u
Formula C23H34O3
InChI InChI=1S/C23H34O3/c1-14(24)26-20-9-7-16-15-6-8-18-21(2,3)19(25)11-13-22(18,4)17(15)10-12-23(16,20)5/h8,15-17,20H,6-7,9-13H2,1-5H3
InChIKey RSQJEZDDLITPIW-UHFFFAOYSA-N
Molecular Weight 358.522 g/mol
Nominal Mass 358 u
SMILES C1(CCC2(C3C(CC=C2C1(C)C)C1C(CC3)(C)C(CC1)OC(C)=O)C)=O