SpectraBase Spectrum ID |
ECjdcu3xF3G |
Name |
2-[2-(1-benzothiophen-2-yl)-2-oxidanylidene-ethyl]propanedioic acid |
CAS Registry Number |
97511-03-0 |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C13H10O5S |
InChI |
InChI=1S/C13H10O5S/c14-9(6-8(12(15)16)13(17)18)11-5-7-3-1-2-4-10(7)19-11/h1-5,8H,6H2,(H,15,16)(H,17,18) |
InChIKey |
KOFMJJHKZWOBGG-UHFFFAOYSA-N |
Molecular Weight |
278.278 g/mol |
SMILES |
OC(C(C(=O)O)CC(c1sc2ccccc2c1)=O)=O |
SPLASH |
splash10-03di-1910000000-aa98d936dd38f55a64fc |
Source of Spectrum |
Y-22-217-22 |
Synonyms |
2-[2-(1-benzothiophen-2-yl)-2-oxoethyl]propanedioic acid
2-[2-(benzothiophen-2-yl)-2-keto-ethyl]malonic acid
2-[2-(benzothiophen-2-yl)-2-oxo-ethyl]propanedioic acid |
Wiley ID |
1281613 |