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Benzoic acid, 4-[2-(2-benzothiazolyl)ethenyl]-, methyl ester
SpectraBase Compound ID JogzXHkEGsC
InChI InChI=1S/C17H13NO2S/c1-20-17(19)13-9-6-12(7-10-13)8-11-16-18-14-4-2-3-5-15(14)21-16/h2-11H,1H3/b11-8+
InChIKey OBWCSCIECZASBQ-DHZHZOJOSA-N
Mol Weight 295.36 g/mol
Molecular Formula C17H13NO2S
Exact Mass 295.0667 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EE91IcdIPmq
Name Benzoic acid, 4-[2-(2-benzothiazolyl)ethenyl]-, methyl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H13NO2S
InChI InChI=1S/C17H13NO2S/c1-20-17(19)13-9-6-12(7-10-13)8-11-16-18-14-4-2-3-5-15(14)21-16/h2-11H,1H3/b11-8+
InChIKey OBWCSCIECZASBQ-DHZHZOJOSA-N
Molecular Weight 295.356 g/mol
SMILES COC(=O)c1ccc(\C=C\c2nc3ccccc3s2)cc1
SPLASH splash10-0002-0090000000-0afac6d954838aa86514
Source of Spectrum JX-2015-2-1445
Synonyms (E)-methyl 4-(2-(benzo[d]thiazol-2-yl)vinyl)benzoate 4-[(E)-2-(1,3-benzothiazol-2-yl)ethenyl]benzoic acid methyl ester Methyl 4-[(E)-2-(1,3-benzothiazol-2-yl)vinyl]benzoate Methyl 4-[(E)-2-(1,3-benzothiazol-2-yl)ethenyl]benzoate
Wiley ID 1723087