| SpectraBase Spectrum ID |
JGnQV6fG3eq |
| Name |
alpha-Pentyl-benzenemethanol |
| CAS Registry Number |
4471-05-0 |
| Classification |
Chemical |
| Comments |
Spectrum verified by crosschecking against external libraries (one reference spectrum with similarity >= 99% found) |
| Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
178.135765199 u |
| Formula |
C12H18O |
| InChI |
InChI=1S/C12H18O/c1-2-3-4-7-11-8-5-6-9-12(11)10-13/h5-6,8-9,13H,2-4,7,10H2,1H3 |
| InChIKey |
QEFLAMNANSNAKU-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
178.275 g/mol |
| Nominal Mass |
178 u |
| Quality |
966 |
| Retention Index |
1287 |
| SMILES |
OCC=1C(=CC=CC1)CCCCC |
| SPLASH |
splash10-0a6r-9600000000-f5c3a60a4c098b50c807 |
| Source of Spectrum |
DigiLab GmbH (C) 2024 |
| Synonyms |
(2-pentylphenyl)methanol |
| Technique |
GC/MS |
| Wiley ID |
DD2024_032557 |
