| SpectraBase Spectrum ID |
58zLWHoJAJX |
| Name |
3-Cyclohexene-1-carboxylic acid, 3-methyl-5-(2-methylpropyl)-4-(phenylthio)-, methyl ester |
| CAS Registry Number |
69063-48-5 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C19H26O2S |
| InChI |
InChI=1S/C19H26O2S/c1-13(2)10-15-12-16(19(20)21-4)11-14(3)18(15)22-17-8-6-5-7-9-17/h5-9,13,15-16H,10-12H2,1-4H3 |
| InChIKey |
CZABPUFKFDMHTD-UHFFFAOYSA-N |
| Molecular Weight |
318.475 g/mol |
| SMILES |
C1(=C(CC(CC1CC(C)C)C(=O)OC)C)Sc1ccccc1 |
| SPLASH |
splash10-0a4l-9311000000-7fed9fa3602e8b4b5e05 |
| Source of Spectrum |
KC-1985-1064-53 |
| Synonyms |
Methyl 5-isobutyl-3-methyl-4-(phenylsulfanyl)-3-cyclohexene-1-carboxylate
Methyl[3-methyl-5-(2-methylpropyl)-4-phenylthiocyclohex-3-ene]-1-carboxylate |
| Wiley ID |
1318608 |
