| SpectraBase Spectrum ID |
B3QeY3g4whE |
| Name |
Hydroxycitronellal |
| CAS Registry Number |
107-75-5 |
| Classification |
Flavor, fragrance |
| Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
172.146329882 u |
| Formula |
C10H20O2 |
| InChI |
InChI=1S/C10H20O2/c1-9(6-8-11)5-4-7-10(2,3)12/h8-9,12H,4-7H2,1-3H3 |
| InChIKey |
WPFVBOQKRVRMJB-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
172.268 g/mol |
| Nominal Mass |
172 u |
| Quality |
911 |
| Retention Index |
1190 |
| SMILES |
OC(CCCC(CC=O)C)(C)C |
| SPLASH |
splash10-0a4l-9000000000-571deea6299513120b55 |
| Source of Spectrum |
DigiLab GmbH (C) 2024 |
| Synonyms |
Octanal,7-hydroxy-3,7-dimethyl
7-Hydroxy-3,7-dimethyloctanal |
| Technique |
GC/MS |
| Wiley ID |
DD2024_030564 |
