| SpectraBase Spectrum ID |
JIOZlII5Cmu |
| Name |
1,4-Cyclohexanedimethanol |
| CAS Registry Number |
3236-47-3 |
| Classification |
Chemical |
| Comments |
Spectrum verified by crosschecking against external libraries (one reference spectrum with similarity >= 99% found); Spectrum verified by independent measurements in external laboratories |
| Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
144.115029753 u |
| Formula |
C8H16O2 |
| InChI |
InChI=1S/C8H16O2/c9-5-7-1-2-8(6-10)4-3-7/h7-10H,1-6H2 |
| InChIKey |
YIMQCDZDWXUDCA-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
144.214 g/mol |
| Nominal Mass |
144 u |
| Quality |
798 |
| Retention Index |
1031 |
| SMILES |
OCC1CCC(CO)CC1 |
| SPLASH |
splash10-00ke-9000000000-4b4d231479d6adde55f5 |
| Source of Spectrum |
DigiLab GmbH (C) 2024 |
| Synonyms |
(4-(Hydroxymethyl)cyclohexyl)methanol |
| Technique |
GC/MS |
| Wiley ID |
DD2024_028039 |
