| SpectraBase Spectrum ID |
FS1b5edXjeX |
| Name |
3-Cyclohexene-1-carboxylic acid, 5-methyl-4-(phenylthio)-, methyl ester |
| Alternate Name(s) |
Methyl 5-methyl-4-(phenylsulfanyl)-3-cyclohexene-1-carboxylate
Methyl-3-methyl-4-phenylthiocyclohex-4-ene-1-carboxylate |
| CAS Registry Number |
98793-52-3 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C15H18O2S |
| InChI |
InChI=1S/C15H18O2S/c1-11-10-12(15(16)17-2)8-9-14(11)18-13-6-4-3-5-7-13/h3-7,9,11-12H,8,10H2,1-2H3 |
| InChIKey |
USONZBKKHDAETJ-UHFFFAOYSA-N |
| Molecular Weight |
262.367 g/mol |
| SMILES |
C1(=CCC(C(=O)OC)CC1C)Sc1ccccc1 |
| SPLASH |
splash10-0gvo-9370000000-3ce7128e52ef702c251c |
| Source of Spectrum |
KC-1985-1064-50 |
| Wiley ID |
1265787 |
