| SpectraBase Spectrum ID |
2q6ztEMVMXt |
| Name |
2(S),4(R)-4-Isopropyl-1-(2-thia-5-oxa-4-oxohexyl)cyclohex-1-en-6-yl benzoate |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C20H26O4S |
| InChI |
InChI=1S/C20H26O4S/c1-14(2)16-9-10-17(12-25-13-19(21)23-3)18(11-16)24-20(22)15-7-5-4-6-8-15/h4-8,10,14,16,18H,9,11-13H2,1-3H3/t16-,18+/m1/s1 |
| InChIKey |
HYJVPUCTNXRXIR-AEFFLSMTSA-N |
| Molecular Weight |
362.484 g/mol |
| SMILES |
C(O[C@@]1(C(=CC[C@](C1)(C(C)C)[H])CSCC(=O)OC)[H])(=O)c1ccccc1 |
| SPLASH |
splash10-0006-9400000000-13f1b702f051783b6f0a |
| Source of Spectrum |
KC-0-2134-3 |
| Synonyms |
(1S,5R)-5-isopropyl-2-{[(2-methoxy-2-oxoethyl)sulfanyl]methyl}-2-cyclohexen-1-yl benzoate
4-Isopropyl-1-(2-thia-5-oxa-4-oxohexyl)cyclohex-1-en-6-yl benzoate
benzoic acid[(1S,5R)-2-[[(2-methoxy-2-oxoethyl)thio]methyl]-5-propan-2-yl-1-cyclohex-2-enyl]ester
benzoic acid[(1S,5R)-5-isopropyl-2-[[(2-keto-2-methoxy-ethyl)thio]methyl]cyclohex-2-en-1-yl]ester
[(1S,5R)-2-[(2-methoxy-2-oxidanylidene-ethyl)sulfanylmethyl]-5-propan-2-yl-cyclohex-2-en-1-yl]benzoate
[(1S,5R)-2-[(2-methoxy-2-oxoethyl)sulfanylmethyl]-5-propan-2-ylcyclohex-2-en-1-yl]benzoate
[(1S,5R)-5-isopropyl-2-[(2-methoxy-2-oxo-ethyl)sulfanylmethyl]cyclohex-2-en-1-yl]benzoate
benzoic acid [(1S,5R)-2-[[(2-methoxy-2-oxoethyl)thio]methyl]-5-propan-2-yl-1-cyclohex-2-enyl] ester
[(1S,5R)-2-[(2-methoxy-2-oxoethyl)sulfanylmethyl]-5-propan-2-ylcyclohex-2-en-1-yl] benzoate
[(1S,5R)-5-isopropyl-2-[(2-methoxy-2-oxo-ethyl)sulfanylmethyl]cyclohex-2-en-1-yl] benzoate
[(1S,5R)-2-[(2-methoxy-2-oxidanylidene-ethyl)sulfanylmethyl]-5-propan-2-yl-cyclohex-2-en-1-yl] benzoate |
| Wiley ID |
830834 |
