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

*Links on SpectraBase are not permalinks.
ESTR-4-ENE-7.ALPHA.-METHYL-17.BETA.-OL-3-ONE(3-O-METHYLOXIME)
SpectraBase Compound ID JJ3ao6Xkvao
InChI InChI=1S/C20H31NO2/c1-12-10-13-11-14(21-23-3)4-5-15(13)16-8-9-20(2)17(19(12)16)6-7-18(20)22/h11-12,15-19,22H,4-10H2,1-3H3/b21-14+
InChIKey NKOARWMKVNDGPQ-KGENOOAVSA-N
Mol Weight 317.47 g/mol
Molecular Formula C20H31NO2
Exact Mass 317.235479 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 KcBIue9z2sW
Name ESTR-4-ENE-7.ALPHA.-METHYL-17.BETA.-OL-3-ONE(3-O-METHYLOXIME)
Alternate Name(s) 17-HYDROXY-7-METHYLESTR-4-EN-3-ONE O-METHYLOXIME
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C20H31NO2
InChI InChI=1S/C20H31NO2/c1-12-10-13-11-14(21-23-3)4-5-15(13)16-8-9-20(2)17(19(12)16)6-7-18(20)22/h11-12,15-19,22H,4-10H2,1-3H3/b21-14+
InChIKey NKOARWMKVNDGPQ-KGENOOAVSA-N
Nominal Mass 317 u
Owner Database Compilation (C) 2005 Wiley & Sons, Inc.
SMILES C=12CC(C)C3C(CCC4(C)C(CCC34)O)C2CC\C(=N/OC)C1
SPLASH splash10-014i-8669000000-b73e598f868eb248a967
Source File Reference LMCM-47620-960F
Source of Spectrum Copyright (C) Dr. Makin, London Hospital Medical College, UK