| SpectraBase Spectrum ID |
Ib8h5PSp0mG |
| Name |
(1R,2S)-2-(hydroxymethyl)cyclohexyl acetate |
| Alternate Name(s) |
trans-2-Hydroxymethylcyclohexyl acetate
cis-2-Hydroxymethylcyclohexyl acetate |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C9H16O3 |
| InChI |
InChI=1S/C9H16O3/c1-7(11)12-9-5-3-2-4-8(9)6-10/h8-10H,2-6H2,1H3/t8-,9+/m0/s1 |
| InChIKey |
ZKMOSUVLVTXHRN-DTWKUNHWSA-N |
| Molecular Weight |
172.224 g/mol |
| SMILES |
OC[C@]1([C@](OC(=O)C)(CCCC1)[H])[H] |
| SPLASH |
splash10-03di-9100000000-cc50f9a78293e323c2cd |
| Source of Spectrum |
KC-0-334-25 |
| Wiley ID |
783135 |
