| SpectraBase Spectrum ID |
DRUHuXBQrE8 |
| Name |
Cyclohexanecarboxylic acid, 5-oxo-2-(phenylmethyl)-, methyl ester, trans- |
| CAS Registry Number |
126790-46-3 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C15H18O3 |
| InChI |
InChI=1S/C15H18O3/c1-18-15(17)14-10-13(16)8-7-12(14)9-11-5-3-2-4-6-11/h2-6,12,14H,7-10H2,1H3/t12-,14+/m0/s1 |
| InChIKey |
YJFLCWDCPYJMPU-GXTWGEPZSA-N |
| Molecular Weight |
246.306 g/mol |
| SMILES |
[C@@]1(C(=O)OC)([C@](Cc2ccccc2)(CCC(C1)=O)[H])[H] |
| SPLASH |
splash10-000f-9220000000-4d1d8c19008ce002f2ca |
| Source of Spectrum |
C-112-4007-18 |
| Synonyms |
Methyl (1R,2S)-2-benzyl-5-oxocyclohexanecarboxylate
trans-3-(methoxycarbonyl)-4-(phenylmethyl)cyclohexanone |
| Wiley ID |
1249232 |
