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

*Links on SpectraBase are not permalinks.
benzoic acid, 4-[[(2-benzoxazolylthio)acetyl]amino]-, butyl ester
SpectraBase Compound ID GoxyzjWhcYA
InChI InChI=1S/C20H20N2O4S/c1-2-3-12-25-19(24)14-8-10-15(11-9-14)21-18(23)13-27-20-22-16-6-4-5-7-17(16)26-20/h4-11H,2-3,12-13H2,1H3,(H,21,23)
InChIKey NFOHHKRQFUXXCS-UHFFFAOYSA-N
Mol Weight 384.45 g/mol
Molecular Formula C20H20N2O4S
Exact Mass 384.114378 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 EdNCEIBNEZY
Name 4-[[2-(1,3-benzoxazol-2-ylthio)-1-oxoethyl]amino]benzoic acid butyl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H20N2O4S
InChI InChI=1S/C20H20N2O4S/c1-2-3-12-25-19(24)14-8-10-15(11-9-14)21-18(23)13-27-20-22-16-6-4-5-7-17(16)26-20/h4-11H,2-3,12-13H2,1H3,(H,21,23)
InChIKey NFOHHKRQFUXXCS-UHFFFAOYSA-N
Molecular Weight 384.450 g/mol
SMILES N(C(CSc1nc2ccccc2o1)=O)c1ccc(C(=O)OCCCC)cc1
SPLASH splash10-03xu-4900000000-64a15592c0cc45d25ee3
Synonyms 4-[[2-(1,3-benzoxazol-2-ylthio)acetyl]amino]benzoic acid butyl ester Butyl 4-[2-(1,3-benzoxazol-2-ylsulfanyl)ethanoylamino]benzoate Butyl 4-[[2-(1,3-benzoxazol-2-ylsulfanyl)acetyl]amino]benzoate Butyl 4-{[(1,3-benzoxazol-2-ylsulfanyl)acetyl]amino}benzoate
Wiley ID 1451721