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

*Links on SpectraBase are not permalinks.

4-(1,3-benzoxazol-2-ylsulfanyl)-5-methyl-benzene-1,2-diol

View entire compound with spectra: 3 MS (GC)

4-(1,3-benzoxazol-2-ylsulfanyl)-5-methyl-benzene-1,2-diol
SpectraBase Compound ID ICv8mV7onef
InChI InChI=1S/C14H11NO3S/c1-8-6-10(16)11(17)7-13(8)19-14-15-9-4-2-3-5-12(9)18-14/h2-7,16-17H,1H3
InChIKey KESZDUHXYANZSN-UHFFFAOYSA-N
Mol Weight 273.31 g/mol
Molecular Formula C14H11NO3S
Exact Mass 273.045964 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 5PuFVIAqcBc
Name 4-(1,3-benzoxazol-2-ylsulfanyl)-5-methyl-benzene-1,2-diol
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H11NO3S
InChI InChI=1S/C14H11NO3S/c1-8-6-10(16)11(17)7-13(8)19-14-15-9-4-2-3-5-12(9)18-14/h2-7,16-17H,1H3
InChIKey KESZDUHXYANZSN-UHFFFAOYSA-N
Literature Reference DOI 10.1248/cpb.59.1149
Molecular Weight 273.306 g/mol
SMILES Oc1c(cc(c(c1)C)Sc1nc2c(o1)cccc2)O
SPLASH splash10-00xu-4590000000-5cdea981225242986b06
Source of Spectrum E1-59-1151-3B
Synonyms 4-(benzo[d]oxazol-2'-ylthio)-5-methylbenzene-1,2-diol 4-(1,3-benzoxazol-2-ylthio)-5-methyl-pyrocatechol 4-(Benzo[d]oxazol-2-ylthio)-5-methylbenzene-1,2-diol 4-(1,3-benzoxazol-2-ylthio)-5-methylbenzene-1,2-diol 4-(1,3-benzoxazol-2-ylsulfanyl)-5-methylbenzene-1,2-diol
Wiley ID 1743714