SpectraBase Spectrum ID |
4Ybqs2IMpjZ |
Name |
Benzoic acid, 2-(naphtho[2,3-b]thien-2-ylmethyl)- |
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 |
Synonyms |
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 |
Wiley ID |
1318681 |