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S-(1,3-Benzoxazol-2-yl) 2-benzoylbenzenecarbothioate
SpectraBase Compound ID KXBHdtyKI9z
InChI InChI=1S/C21H13NO3S/c23-19(14-8-2-1-3-9-14)15-10-4-5-11-16(15)20(24)26-21-22-17-12-6-7-13-18(17)25-21/h1-13H
InChIKey DJLZRWVLGJTNHV-UHFFFAOYSA-N
Mol Weight 359.4 g/mol
Molecular Formula C21H13NO3S
Exact Mass 359.061614 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HMwUHwSeYwQ
Name S-(1,3-Benzoxazol-2-yl) 2-benzoylbenzenecarbothioate
CAS Registry Number 300568-44-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H13NO3S
InChI InChI=1S/C21H13NO3S/c23-19(14-8-2-1-3-9-14)15-10-4-5-11-16(15)20(24)26-21-22-17-12-6-7-13-18(17)25-21/h1-13H
InChIKey DJLZRWVLGJTNHV-UHFFFAOYSA-N
Molecular Weight 359.399 g/mol
SMILES c1c2c(ccc1)nc(o2)SC(=O)c1ccccc1C(c1ccccc1)=O
SPLASH splash10-0a4i-6590000000-2d57a5d3958ad443cca5
Source of Spectrum AD-0-2532-0
Synonyms 2-Benzoylbenzenecarbothioic acid S-(1,3-benzoxazol-2-yl) ester 2-Benzoylthiobenzoic acid S-(1,3-benzoxazol-2-yl) ester S-(1,3-benzoxazol-2-yl) 2-(phenylcarbonyl)benzenecarbothioate Thiobenzoic acid, 2-benzoyl-, S-(2-benzoxazolyl) ester
Wiley ID 1424489