| SpectraBase Spectrum ID |
9X45rJRROIe |
| Name |
1-Heptanone, 2,2,5-trimethyl-1-phenyl-, (S)- |
| Alternate Name(s) |
(5S)-2,2,5-trimethyl-1-phenyl-1-heptanone
(5S)-2,2,5-trimethyl-1-phenylheptan-1-one |
| CAS Registry Number |
61067-09-2 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C16H24O |
| InChI |
InChI=1S/C16H24O/c1-5-13(2)11-12-16(3,4)15(17)14-9-7-6-8-10-14/h6-10,13H,5,11-12H2,1-4H3/t13-/m0/s1 |
| InChIKey |
XAASQMJXNWDARU-ZDUSSCGKSA-N |
| Molecular Weight |
232.367 g/mol |
| SMILES |
C(C(CC[C@](CC)(C)[H])(C)C)(=O)c1ccccc1 |
| SPLASH |
splash10-0a4j-0900000000-8f7f30cc030c0a434342 |
| Source of Spectrum |
C-98-6222-0 |
| Wiley ID |
1234364 |
