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CAS Number: 1189816-02-1
4,5-dihydrobenzo[2,3]oxepino[4,5-d]thiazole-2-carboxylic acid

Structure

4,5-dihydrobenzo[2,3]oxepino[4,5-d]thiazole-2-carboxylic acid
Name: 4,5-dihydrobenzo[2,3]oxepino[4,5-d]thiazole-2-carboxylic acid
Synonyms:
General Information
Product Number: 1189816021

CAS:1189816-02-1

Name:4,5-dihydrobenzo[2,3]oxepino[4,5-d]thiazole-2-carboxylic acid

Chemical Formula: C12H9NO3S
Exact Mass: 247.03
Molecular Weight: 247.27
m/z: 247.03 (100.0%), 248.03 (14.3%), 249.03 (5.3%)
Elemental Analysis: C, 58.29; H, 3.67; N, 5.66; O, 19.41; S, 12.97
 
SMILES:c1ccc2c(c1)-c3c(sc(n3)C(=O)O)CCO2
Std. InChI:InChI=S/C12H9NO3S/c14-12(15)11-13-10-7-3-1-2-4-8(7)16-6-5-9(10)17-11/h1-4H,5-6H2,(H,14,15)
Std. InChIKey:UHMJNCRJDIFZIB-UHFFFAOYSA-N

Specification

98%

References

U.S. Pat. Appl. Publ., 20090247567, 01 Oct 2009

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