| SpectraBase Spectrum ID |
5VBQ2kuLIWN |
| Name |
2-Hydroxy-2-trifluoromethyl-3-[N'-methyl-N'-acetylamido]-1,5-benzothiazepine-4-one |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C13H13F3N2O3S |
| InChI |
InChI=1S/C13H13F3N2O3S/c1-7(19)18(2)10-11(20)17-8-5-3-4-6-9(8)22-12(10,21)13(14,15)16/h3-6,10,21H,1-2H3,(H,17,20) |
| InChIKey |
MNJUZXXQGIEASG-UHFFFAOYSA-N |
| Molecular Weight |
334.313 g/mol |
| SMILES |
N1c2c(SC(C(C1=O)N(C(=O)C)C)(C(F)(F)F)O)cccc2 |
| SPLASH |
splash10-0udi-0900000000-cbec4f596e79200731bb |
| Source of Spectrum |
O1-55-1923-4 |
| Wiley ID |
1591375 |
![2-Hydroxy-2-trifluoromethyl-3-[N'-methyl-N'-acetylamido]-1,5-benzothiazepine-4-one](/api/spectrum/5VBQ2kuLIWN/structure.png?h=300&w=458 "2-Hydroxy-2-trifluoromethyl-3-[N'-methyl-N'-acetylamido]-1,5-benzothiazepine-4-one")
