| SpectraBase Spectrum ID |
JEdrJ7LBszA |
| Name |
Cyclohexanecarboxylic acid |
| CAS Registry Number |
98-89-5 |
| Classification |
Chemical |
| Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
128.083729624 u |
| Formula |
C7H12O2 |
| InChI |
InChI=1S/C7H12O2/c8-7(9)6-4-2-1-3-5-6/h6H,1-5H2,(H,8,9) |
| InChIKey |
NZNMSOFKMUBTKW-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
128.171 g/mol |
| Nominal Mass |
128 u |
| Quality |
962 |
| Retention Index |
1412 |
| SMILES |
OC(C1CCCCC1)=O |
| SPLASH |
splash10-0a4i-9000000000-e7f07b1f948d728cf625 |
| Source of Spectrum |
DigiLab GmbH (C) 2024 |
| Synonyms |
cyclohexanecarboxylic acid |
| Technique |
GC/MS |
| Wiley ID |
DD2024_032185 |
