| SpectraBase Spectrum ID |
3j2Bcrc2BAX |
| Name |
4-Heptanone, 2-methyl-6-(4-methylphenyl)-3-(phenylsulfinyl)- |
| Alternate Name(s) |
2-Methyl-6-(4-methylphenyl)-3-(phenylsulfinyl)-4-heptanone
2-Methyl-6-(p-tolyl)-3-phenylsulpinylheptan-4-one |
| CAS Registry Number |
98711-79-6 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C21H26O2S |
| InChI |
InChI=1S/C21H26O2S/c1-15(2)21(24(23)19-8-6-5-7-9-19)20(22)14-17(4)18-12-10-16(3)11-13-18/h5-13,15,17,21H,14H2,1-4H3 |
| InChIKey |
LZPOXPYJRNUYFV-UHFFFAOYSA-N |
| Molecular Weight |
342.497 g/mol |
| SMILES |
C(S(=O)c1ccccc1)(C(CC(c1ccc(cc1)C)C)=O)C(C)C |
| SPLASH |
splash10-014i-0920000000-ff1ff4767454cad5dbca |
| Source of Spectrum |
KC-1985-1242-38 |
| Wiley ID |
1336778 |
