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

*Links on SpectraBase are not permalinks.
D-Homoestr-4-en-3-one, 17a-(1,1-dimethylethoxy)-, (17a.beta.)-
SpectraBase Compound ID 1eedCwHoR7Z
InChI InChI=1S/C23H36O2/c1-22(2,3)25-21-7-5-6-20-19-10-8-15-14-16(24)9-11-17(15)18(19)12-13-23(20,21)4/h14,17-21H,5-13H2,1-4H3/t17-,18+,19+,20-,21-,23-/m0/s1
InChIKey PGMBNNUWCVFXGJ-ZBVDZRMISA-N
Mol Weight 344.5 g/mol
Molecular Formula C23H36O2
Exact Mass 344.27153 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

Subscribe to view the full spectrum.

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

SpectraBase Spectrum ID E3OnZEIhexX
Name D-Homoestr-4-en-3-one, 17A-(1,1-dimethylethoxy)-, (17A.beta.)-
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 344.271530397 u
Formula C23H36O2
InChI InChI=1S/C23H36O2/c1-22(2,3)25-21-7-5-6-20-19-10-8-15-14-16(24)9-11-17(15)18(19)12-13-23(20,21)4/h14,17-21H,5-13H2,1-4H3/t17-,18+,19+,20-,21-,23-/m0/s1
InChIKey PGMBNNUWCVFXGJ-ZBVDZRMISA-N
Molecular Weight 344.539 g/mol
SMILES [C@@]12([C@]([C@@]3(CCC=4[C@@]([C@]3(CC2)[H])(CCC(=O)C4)[H])[H])(CCC[C@@]1(OC(C)(C)C)[H])[H])C