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1-Naphthalenecarboxylic acid, 8-(1,2-benzisothiazol-3-yl)-, methyl ester
SpectraBase Compound ID 5tMc07cigCX
InChI InChI=1S/C19H13NO2S/c1-22-19(21)15-10-5-7-12-6-4-9-14(17(12)15)18-13-8-2-3-11-16(13)23-20-18/h2-11H,1H3
InChIKey DCLPYVRRMVDYEX-UHFFFAOYSA-N
Mol Weight 319.38 g/mol
Molecular Formula C19H13NO2S
Exact Mass 319.0667 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8N2eNcwm0jc
Name 1-Naphthalenecarboxylic acid, 8-(1,2-benzisothiazol-3-yl)-, methyl ester
CAS Registry Number 117402-57-0
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H13NO2S
InChI InChI=1S/C19H13NO2S/c1-22-19(21)15-10-5-7-12-6-4-9-14(17(12)15)18-13-8-2-3-11-16(13)23-20-18/h2-11H,1H3
InChIKey DCLPYVRRMVDYEX-UHFFFAOYSA-N
Molecular Weight 319.378 g/mol
SMILES c1(nsc2c1cccc2)-c1c2c(C(=O)OC)cccc2ccc1
SPLASH splash10-03di-0090000000-924f07c1838a36f97d39
Source of Spectrum KC-1988-2143-10
Synonyms 8-(1,2-Benzisothiazol-3-yl-naphthalene-1-carboxyli acid methyl ester Methyl 8-(1,2-benzisothiazol-3-yl)-1-naphthoate
Wiley ID 1319432