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Benzoic acid, 2-(naphtho[2,3-b]thien-2-ylmethyl)-
SpectraBase Compound ID piYjgV7DKI
InChI InChI=1S/C20H14O2S/c21-20(22)18-8-4-3-7-15(18)10-17-11-16-9-13-5-1-2-6-14(13)12-19(16)23-17/h1-9,11-12H,10H2,(H,21,22)
InChIKey SKNZEUGQDWQMHH-UHFFFAOYSA-N
Mol Weight 318.39 g/mol
Molecular Formula C20H14O2S
Exact Mass 318.071451 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4Ybqs2IMpjZ
Name Benzoic acid, 2-(naphtho[2,3-b]thien-2-ylmethyl)-
Alternate Name(s) 2-(2-benzo[f][1]benzothiolylmethyl)benzoic acid 2-(benzo[f]benzothiophen-2-ylmethyl)benzoic acid 2-(benzo[f][1]benzothiol-2-ylmethyl)benzoic acid
CAS Registry Number 88220-30-8
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H14O2S
InChI InChI=1S/C20H14O2S/c21-20(22)18-8-4-3-7-15(18)10-17-11-16-9-13-5-1-2-6-14(13)12-19(16)23-17/h1-9,11-12H,10H2,(H,21,22)
InChIKey SKNZEUGQDWQMHH-UHFFFAOYSA-N
Molecular Weight 318.390 g/mol
SMILES OC(c1c(Cc2sc3cc4ccccc4cc3c2)cccc1)=O
SPLASH splash10-01b9-0059000000-e9245e54431af183c9f8
Source of Spectrum Y-20-1147-0
Wiley ID 1318681