| SpectraBase Spectrum ID |
7bei0Knh7f7 |
| Name |
5-(benzylthio)-7,7,7-trifluoro-2,2-dimethyl-heptan-3-one |
| Alternate Name(s) |
5-Benzylsulfanyl-7,7,7-trifluoro-2,2-dimethyl-heptan-3-one
7,7,7-trifluoro-2,2-dimethyl-5-(phenylmethylthio)-3-heptanone
7,7,7-tris(fluoranyl)-2,2-dimethyl-5-(phenylmethylsulfanyl)heptan-3-one |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C16H21F3OS |
| InChI |
InChI=1S/C16H21F3OS/c1-15(2,3)14(20)9-13(10-16(17,18)19)21-11-12-7-5-4-6-8-12/h4-8,13H,9-11H2,1-3H3 |
| InChIKey |
HPNJJNOEWWSMIZ-UHFFFAOYSA-N |
| Molecular Weight |
318.398 g/mol |
| SMILES |
C(CC(CC(C(C)(C)C)=O)SCc1ccccc1)(F)(F)F |
| SPLASH |
splash10-006x-9800000000-2befc12f605422b0124b |
| Source of Spectrum |
KC-0-281-8 |
| Wiley ID |
824283 |
