| SpectraBase Spectrum ID |
EmQaQpQK3Sz |
| Name |
Thioacetic acid, S-(7-acetyl-9-oxo-8,9-dihydro-7H-10-oxa-5,7-diazabenzocycloocten-6-yl) ester |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C13H12N2O4S |
| InChI |
InChI=1S/C13H12N2O4S/c1-8(16)15-7-12(18)19-11-6-4-3-5-10(11)14-13(15)20-9(2)17/h3-6H,7H2,1-2H3/b14-13+ |
| InChIKey |
BUPXKSGSCSSADV-BUHFOSPRSA-N |
| Molecular Weight |
292.309 g/mol |
| SMILES |
C(N1\C(=N/c2c(OC(C1)=O)cccc2)SC(=O)C)(=O)C |
| SPLASH |
splash10-0006-9310000000-44c3e97d5a927c37194b |
| Source of Spectrum |
AD-0-2532-0 |
| Wiley ID |
1436296 |
