| SpectraBase Spectrum ID |
ElfY2BQ3eEb |
| Name |
3-Trifluoromethanesulfonyl-2,3,4,5-tetrahydro-benzo[d]azepin-1-one |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C11H10F3NO3S |
| InChI |
InChI=1S/C11H10F3NO3S/c12-11(13,14)19(17,18)15-6-5-8-3-1-2-4-9(8)10(16)7-15/h1-4H,5-7H2 |
| InChIKey |
WMMYDHKKVQPGAE-UHFFFAOYSA-N |
| Molecular Weight |
293.260 g/mol |
| SMILES |
C1N(S(C(F)(F)F)(=O)=O)CCc2ccccc2C1=O |
| SPLASH |
splash10-03di-0900000000-0de0d262187f3ce5094d |
| Source of Spectrum |
H1-45-1125-2 |
| Synonyms |
3-(Trifluoromethanesulfonyl)benzaepinone
3-[(trifluoromethyl)sulfonyl]-2,3,4,5-tetrahydro-1H-3-benzazepin-1-one |
| Wiley ID |
758299 |
