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

*Links on SpectraBase are not permalinks.
17-(Methoxyimino)-4-nitroestra-1(10),2,4-trien-3-yl acetate
SpectraBase Compound ID 9w1RdL7sfhO
InChI InChI=1S/C21H26N2O5/c1-12(24)28-18-8-6-13-14-10-11-21(2)17(7-9-19(21)22-27-3)15(14)4-5-16(13)20(18)23(25)26/h6,8,14-15,17H,4-5,7,9-11H2,1-3H3/b22-19+
InChIKey IAZCDJNWFPFLPX-ZBJSNUHESA-N
Mol Weight 386.45 g/mol
Molecular Formula C21H26N2O5
Exact Mass 386.184172 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 CGO3IliOC0n
Name 17-(Methoxyimino)-4-nitroestra-1(10),2,4-trien-3-yl acetate
CAS Registry Number 77883-07-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H26N2O5
InChI InChI=1S/C21H26N2O5/c1-12(24)28-18-8-6-13-14-10-11-21(2)17(7-9-19(21)22-27-3)15(14)4-5-16(13)20(18)23(25)26/h6,8,14-15,17H,4-5,7,9-11H2,1-3H3/b22-19+
InChIKey IAZCDJNWFPFLPX-ZBJSNUHESA-N
Molecular Weight 386.448 g/mol
SMILES CO\N=C/1CCC2C3CCc4c(ccc(OC(C)=O)c4N(=O)=O)C3CCC12C
SPLASH splash10-03di-3339000000-ba84295cbd6a9d16e71e
Source of Spectrum W5-0-0-0
Synonyms Estra-1,3,5(10)-trien-17-one, 3-(acetyloxy)-4-nitro-, 17-(O-methyloxime)
Wiley ID 1362628