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

*Links on SpectraBase are not permalinks.
4H-1-Benzothiopyran-4-one, 3-[(4-nitrophenyl)amino]-, 1,1-dioxide
SpectraBase Compound ID 1434uxUR1Ol
InChI InChI=1S/C15H10N2O5S/c18-15-12-3-1-2-4-14(12)23(21,22)9-13(15)16-10-5-7-11(8-6-10)17(19)20/h1-9,16H
InChIKey AJJSRACVMNKWDS-UHFFFAOYSA-N
Mol Weight 330.31 g/mol
Molecular Formula C15H10N2O5S
Exact Mass 330.031043 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 ZyraMqmHSV
Name 4H-1-Benzothiopyran-4-one, 3-[(4-nitrophenyl)amino]-, 1,1-dioxide
CAS Registry Number 116884-87-8
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H10N2O5S
InChI InChI=1S/C15H10N2O5S/c18-15-12-3-1-2-4-14(12)23(21,22)9-13(15)16-10-5-7-11(8-6-10)17(19)20/h1-9,16H
InChIKey AJJSRACVMNKWDS-UHFFFAOYSA-N
Molecular Weight 330.314 g/mol
SMILES N(C1=CS(c2c(C1=O)cccc2)(=O)=O)c1ccc(N(=O)=O)cc1
SPLASH splash10-0udi-0029000000-14e446d2dfa6ea1ec0a4
Source of Spectrum KC-1988-1834-6
Synonyms 3-(4-nitroanilino)-4H-1-benzothiopyran-4-one 1,1-dioxide 4H-2-(p-nitroanilino)-1-benzothiopyran-4-one 1,1-dioxide
Wiley ID 1327519