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

*Links on SpectraBase are not permalinks.
3-[2-(2-chloro-benzylsulfanyl)-phenylamino]-3H-isobenzofuran-1-one
SpectraBase Compound ID 7eEtaLtO0QU
InChI InChI=1S/C21H16ClNO2S/c22-17-10-4-1-7-14(17)13-26-19-12-6-5-11-18(19)23-20-15-8-2-3-9-16(15)21(24)25-20/h1-12,20,23H,13H2
InChIKey ZJOATHLJOLIESV-UHFFFAOYSA-N
Mol Weight 381.88 g/mol
Molecular Formula C21H16ClNO2S
Exact Mass 381.059028 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 8VhwiQLduIh
Name 3-[2-(2-chloro-benzylsulfanyl)-phenylamino]-3H-isobenzofuran-1-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H16ClNO2S
InChI InChI=1S/C21H16ClNO2S/c22-17-10-4-1-7-14(17)13-26-19-12-6-5-11-18(19)23-20-15-8-2-3-9-16(15)21(24)25-20/h1-12,20,23H,13H2
InChIKey ZJOATHLJOLIESV-UHFFFAOYSA-N
Molecular Weight 381.877 g/mol
SMILES N(C1OC(=O)c2c1cccc2)c1c(SCc2c(Cl)cccc2)cccc1
SPLASH splash10-0560-4962000000-380e3aececb011c1a5c4
Synonyms 3-[2-[(2-Chlorobenzyl)thio]anilino]phthalide 3-[2-[(2-chlorophenyl)methylsulfanyl]anilino]-3H-2-benzofuran-1-one 3-[2-[(2-chlorophenyl)methylsulfanyl]anilino]-3H-isobenzofuran-1-one 3-[2-[(2-chlorophenyl)methylthio]anilino]-3H-isobenzofuran-1-one 3-[[2-[(2-chlorophenyl)methylsulfanyl]phenyl]amino]-3H-2-benzofuran-1-one 3-{2-[(2-chlorobenzyl)sulfanyl]anilino}-2-benzofuran-1(3H)-one
Wiley ID 1451546