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Benzoic acid, 2-(naphtho[2,1-b]thien-2-ylcarbonyl)-
SpectraBase Compound ID DSidwKwKTLf
InChI InChI=1S/C20H12O3S/c21-19(14-7-3-4-8-15(14)20(22)23)18-11-16-13-6-2-1-5-12(13)9-10-17(16)24-18/h1-11H,(H,22,23)
InChIKey XZCMRRGNLPOCRP-UHFFFAOYSA-N
Mol Weight 332.37 g/mol
Molecular Formula C20H12O3S
Exact Mass 332.050715 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 26Y3NXMLmmU
Name Benzoic acid, 2-(naphtho[2,1-b]thien-2-ylcarbonyl)-
CAS Registry Number 88220-21-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H12O3S
InChI InChI=1S/C20H12O3S/c21-19(14-7-3-4-8-15(14)20(22)23)18-11-16-13-6-2-1-5-12(13)9-10-17(16)24-18/h1-11H,(H,22,23)
InChIKey XZCMRRGNLPOCRP-UHFFFAOYSA-N
Molecular Weight 332.373 g/mol
SMILES OC(c1c(C(c2cc3c4c(cccc4)ccc3s2)=O)cccc1)=O
SPLASH splash10-03ei-0982000000-cddd4ff4d50b95528f5b
Source of Spectrum Y-20-1146-0
Synonyms 2-(benzo[e]benzothiophene-2-carbonyl)benzoic acid 2-(benzo[e][1]benzothiole-2-carbonyl)benzoic acid 2-Benzo[e][1]benzothiol-2-ylcarbonylbenzoic acid 2-[2-benzo[e][1]benzothiolyl(oxo)methyl]benzoic acid
Wiley ID 1329534