| SpectraBase Spectrum ID |
3PzP6zmiRGv |
| Name |
(1S,3S)-3-(hydroxymethyl)-5-oxidanylidene-cyclohexane-1-carboxylic acid |
| CAS Registry Number |
123559-36-4 |
| Copyright |
Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C8H12O4 |
| InChI |
InChI=1S/C8H12O4/c9-4-5-1-6(8(11)12)3-7(10)2-5/h5-6,9H,1-4H2,(H,11,12)/t5-,6-/m0/s1 |
| InChIKey |
AWEIERBVWHIOAF-WDSKDSINSA-N |
| Molecular Weight |
172.180 g/mol |
| SMILES |
OC([C@]1(C[C@](CO)(CC(C1)=O)[H])[H])=O |
| SPLASH |
splash10-0006-9300000000-3aa0db90c50b8400663d |
| Source of Spectrum |
F-45-1400-6 |
| Synonyms |
(1S,3S)-3-(hydroxymethyl)-5-oxo-1-cyclohexanecarboxylic acid
(1S,3S)-3-(hydroxymethyl)-5-oxo-cyclohexanecarboxylic acid
(1S,3S)-3-(hydroxymethyl)-5-oxocyclohexane-1-carboxylic acid
(1S,5S)-3-keto-5-methylol-cyclohexanecarboxylic acid |
| Wiley ID |
1168474 |
