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

*Links on SpectraBase are not permalinks.
(2E)-3-(1,3-Benzoxazol-2-ylsulfanyl)-1-(4-methylphenyl)-2-propen-1-one
SpectraBase Compound ID 3U1ffyaMRwF
InChI InChI=1S/C17H13NO2S/c1-12-6-8-13(9-7-12)15(19)10-11-21-17-18-14-4-2-3-5-16(14)20-17/h2-11H,1H3/b11-10+
InChIKey OTUGXZMXDBRYBG-ZHACJKMWSA-N
Mol Weight 295.36 g/mol
Molecular Formula C17H13NO2S
Exact Mass 295.0667 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 5sQf8MNYm1T
Name (2E)-3-(1,3-Benzoxazol-2-ylsulfanyl)-1-(4-methylphenyl)-2-propen-1-one
CAS Registry Number 276880-67-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H13NO2S
InChI InChI=1S/C17H13NO2S/c1-12-6-8-13(9-7-12)15(19)10-11-21-17-18-14-4-2-3-5-16(14)20-17/h2-11H,1H3/b11-10+
InChIKey OTUGXZMXDBRYBG-ZHACJKMWSA-N
Molecular Weight 295.356 g/mol
SMILES c1ccc2nc(oc2c1)S\C=C\C(c1ccc(cc1)C)=O
SPLASH splash10-004i-5900000000-d7b6570c3c623ccd7a14
Source of Spectrum AD-0-2532-0
Synonyms (E)-3-(1,3-benzoxazol-2-ylsulfanyl)-1-(4-methylphenyl)prop-2-en-1-one (E)-3-(1,3-benzoxazol-2-ylsulfanyl)-1-(p-tolyl)prop-2-en-1-one (E)-3-(1,3-benzoxazol-2-ylthio)-1-(4-methylphenyl)-2-propen-1-one (E)-3-(1,3-benzoxazol-2-ylthio)-1-(p-tolyl)prop-2-en-1-one 2-Propen-1-one, 3-(2-benzoxazolylthio)-1-(4-methylphenyl)-
Wiley ID 1425335