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

*Links on SpectraBase are not permalinks.
3-Methoxy-4-nitroestra-1(10),2,4-trien-17-one o-methyloxime
SpectraBase Compound ID F5RlE8VH2aX
InChI InChI=1S/C20H26N2O4/c1-20-11-10-13-12-6-8-17(25-2)19(22(23)24)15(12)5-4-14(13)16(20)7-9-18(20)21-26-3/h6,8,13-14,16H,4-5,7,9-11H2,1-3H3/b21-18+
InChIKey MFUFTTYLJDXOIM-DYTRJAOYSA-N
Mol Weight 358.44 g/mol
Molecular Formula C20H26N2O4
Exact Mass 358.189257 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 6L9lS4I7Q2q
Name 3-Methoxy-4-nitroestra-1(10),2,4-trien-17-one o-methyloxime
CAS Registry Number 77883-06-8
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H26N2O4
InChI InChI=1S/C20H26N2O4/c1-20-11-10-13-12-6-8-17(25-2)19(22(23)24)15(12)5-4-14(13)16(20)7-9-18(20)21-26-3/h6,8,13-14,16H,4-5,7,9-11H2,1-3H3/b21-18+
InChIKey MFUFTTYLJDXOIM-DYTRJAOYSA-N
Molecular Weight 358.438 g/mol
SMILES CO\N=C/1CCC2C3CCc4c(ccc(OC)c4N(=O)=O)C3CCC12C
SPLASH splash10-004i-2379000000-28ee4d797f64e43ff2d8
Source of Spectrum W5-0-0-0
Synonyms Estra-1,3,5(10)-trien-17-one, 3-methoxy-4-nitro-, O-methyloxime
Wiley ID 1347099