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

*Links on SpectraBase are not permalinks.

4-(4-Bromo-2-methylanilino)-4-oxobutanoic acid

View entire compound with spectra: 1 MS (GC)

4-(4-Bromo-2-methylanilino)-4-oxobutanoic acid
SpectraBase Compound ID G90uUEaUwCE
InChI InChI=1S/C11H12BrNO3/c1-7-6-8(12)2-3-9(7)13-10(14)4-5-11(15)16/h2-3,6H,4-5H2,1H3,(H,13,14)(H,15,16)
InChIKey PHUOHCZHYKRVRT-UHFFFAOYSA-N
Mol Weight 286.12 g/mol
Molecular Formula C11H12BrNO3
Exact Mass 285.000056 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 1i2qEV4tGq
Name 4-(4-Bromo-2-methylanilino)-4-oxobutanoic acid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H12BrNO3
InChI InChI=1S/C11H12BrNO3/c1-7-6-8(12)2-3-9(7)13-10(14)4-5-11(15)16/h2-3,6H,4-5H2,1H3,(H,13,14)(H,15,16)
InChIKey PHUOHCZHYKRVRT-UHFFFAOYSA-N
Molecular Weight 286.125 g/mol
SMILES N(c1c(cc(cc1)Br)C)C(CCC(=O)O)=O
SPLASH splash10-0kbs-9600000000-94eec5003d1264bccd16
Synonyms 4-(4-bromo-2-methyl-anilino)-4-keto-butyric acid 4-[(4-bromanyl-2-methyl-phenyl)amino]-4-oxidanylidene-butanoic acid
Wiley ID 1450969