| SpectraBase Spectrum ID |
KXdJeeApDG0 |
| Name |
1-Phenyl-3-propanol |
| CAS Registry Number |
122-97-4 |
| 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 |
136.088815005 u |
| Formula |
C9H12O |
| InChI |
InChI=1S/C9H12O/c10-8-4-7-9-5-2-1-3-6-9/h1-3,5-6,10H,4,7-8H2 |
| InChIKey |
VAJVDSVGBWFCLW-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
136.194 g/mol |
| Nominal Mass |
136 u |
| Quality |
752 |
| Retention Index |
1250 |
| SMILES |
OCCCC1=CC=CC=C1 |
| SPLASH |
splash10-014l-9800000000-abe00f89c78bea2ca2f6 |
| Source of Spectrum |
DigiLab GmbH (C) 2024 |
| Synonyms |
Hydrocinnamyl alcohol
Phenylpropanol
Benzenepropanol |
| Technique |
GC/MS |
| Wiley ID |
DD2024_022307 |
