| SpectraBase Spectrum ID |
CBXbsgeNfmZ |
| Name |
7-chloro-5-keto-4H-thieno[2,3-b][1,4]benzoxazepine-2-carboxylic acid methyl ester |
| Alternate Name(s) |
7-chloro-5-oxo-4H-thieno[2,3-b][1,4]benzoxazepine-2-carboxylic acid methyl ester
methyl 7-chloranyl-5-oxidanylidene-4H-thieno[2,3-b][1,4]benzoxazepine-2-carboxylate
methyl 7-chloro-5-oxo-4H-thieno[2,3-b][1,4]benzoxazepine-2-carboxylate |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C13H8ClNO4S |
| InChI |
InChI=1S/C13H8ClNO4S/c1-18-12(17)10-5-8-13(20-10)19-9-3-2-6(14)4-7(9)11(16)15-8/h2-5H,1H3,(H,15,16) |
| InChIKey |
GVLWWMCFYOITDW-UHFFFAOYSA-N |
| Molecular Weight |
309.723 g/mol |
| SMILES |
N1c2c(Oc3c(C1=O)cc(cc3)Cl)sc(c2)C(=O)OC |
| SPLASH |
splash10-0zfr-0089000000-f69b928cd68010ea1fbe |
| Source of Spectrum |
Y-31-1057-4 |
| Wiley ID |
761703 |
![7-chloro-5-keto-4H-thieno[2,3-b][1,4]benzoxazepine-2-carboxylic acid methyl ester](/api/spectrum/CBXbsgeNfmZ/structure.png?h=300&w=458 "7-chloro-5-keto-4H-thieno[2,3-b][1,4]benzoxazepine-2-carboxylic acid methyl ester")
