| SpectraBase Spectrum ID |
K2SskLts5OO |
| Name |
1,3-Diketo-1-phenyl-benzothiophene-2-carboxylic acid ethyl ester |
| CAS Registry Number |
120571-36-0 |
| Comments |
Note: The molecular formula of the structure shown is C17H16O4S - which differs from the formula reported for the mass spectrum (C17H14O4S) |
| Copyright |
Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C17H14O4S |
| InChI |
InChI=1S/C17H14O4S/c1-2-21-17(19)16-15(18)13-10-6-7-11-14(13)22(16,20)12-8-4-3-5-9-12/h3-11H,2H2,1H3 |
| InChIKey |
OLNMVOJXFWFKRO-UHFFFAOYSA-N |
| Molecular Weight |
314.355 g/mol |
| SMILES |
C=1([S+](c2c(C1[O-])cccc2)(=O)c1ccccc1)C(=O)OCC |
| SPLASH |
splash10-02t9-2893000000-92ccd5a2dcf6933d2c06 |
| Source of Spectrum |
F-46-6539-12 |
| Synonyms |
1,3-Dioxo-1-phenyl-1-benzothiophene-2-carboxylic acid ethyl ester
Ethyl 1,3-bis(oxidanylidene)-1-phenyl-1-benzothiophene-2-carboxylate
Ethyl 1,3-dioxo-1-phenyl-1-benzothiophene-2-carboxylate
Ethyl 1,3-dioxo-1-phenyl-benzothiophene-2-carboxylate |
| Wiley ID |
1314947 |
