| SpectraBase Spectrum ID |
GvQMT73bJsV |
| Name |
5-Hepten-2-one, 3,3-dimethyl-1-[(4-methylphenyl)sulfonyl]-, (E)- |
| CAS Registry Number |
109787-56-6 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C16H22O3S |
| InChI |
InChI=1S/C16H22O3S/c1-5-6-11-16(3,4)15(17)12-20(18,19)14-9-7-13(2)8-10-14/h5-10H,11-12H2,1-4H3/b6-5+ |
| InChIKey |
CNBQPNPGZOFAKV-AATRIKPKSA-N |
| Molecular Weight |
294.409 g/mol |
| SMILES |
C(S(c1ccc(cc1)C)(=O)=O)C(C(C\C=C\C)(C)C)=O |
| SPLASH |
splash10-052f-9110000000-04ad0990599982397d73 |
| Source of Spectrum |
J-52-4042-8 |
| Synonyms |
(5E)-3,3-dimethyl-1-[(4-methylphenyl)sulfonyl]-5-hepten-2-one
(E)-3,3-Dimethyl-1-[(4-methylphenyl)sulfonyl]-5-hepten-2-one |
| Wiley ID |
1297099 |
![5-Hepten-2-one, 3,3-dimethyl-1-[(4-methylphenyl)sulfonyl]-, (E)-](/api/spectrum/GvQMT73bJsV/structure.png?h=300&w=458 "5-Hepten-2-one, 3,3-dimethyl-1-[(4-methylphenyl)sulfonyl]-, (E)-")
