| SpectraBase Spectrum ID |
JUaaIX2BKot |
| Name |
3-Amino-2,3-dihydro-1,5-benzothiazepin-4(5H)-one |
| Alternate Name(s) |
3-amino-3,5-dihydro-2H-1,5-benzothiazepin-4-one
3-azanyl-3,5-dihydro-2H-1,5-benzothiazepin-4-one |
| CAS Registry Number |
94590-63-3 |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C9H10N2OS |
| InChI |
InChI=1S/C9H10N2OS/c10-6-5-13-8-4-2-1-3-7(8)11-9(6)12/h1-4,6H,5,10H2,(H,11,12) |
| InChIKey |
CVTKHBONQJBXKR-UHFFFAOYSA-N |
| Molecular Weight |
194.252 g/mol |
| SMILES |
N1c2c(SCC(C1=O)N)cccc2 |
| SPLASH |
splash10-0006-9200000000-7d5141190ea996c2f545 |
| Source of Spectrum |
U-1992-404-5 |
| Wiley ID |
764183 |
