| SpectraBase Spectrum ID |
ECRhhO6t4un |
| Name |
Benzyl alcohol |
| Acquisition Mode |
SIMULTANEOUS |
| CAS Registry Number |
100-51-6 |
| ChEBI ID |
17987 |
| Comments |
100 mM Benzyl alcohol - Sigma-Aldrich; Solvent D2O; Buffer sodium phosphate; Cytocide sodium azide; Reference DSS; pH 7.4, temperature 298 K |
| Copyright |
Database Compilation Copyright © 2021-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Data Source |
Madison Metabolomics Consortium |
| Formula |
C7H8O |
| IUPAC Name |
phenylmethanol |
| InChI |
InChI=1S/C7H8O/c8-6-7-4-2-1-3-5-7/h1-5,8H,6H2 |
| InChIKey |
WVDDGKGOMKODPV-UHFFFAOYSA-N |
| KEGG Compound ID |
C00556 |
| KEGG Pathways |
PATH: ko00622 Toluene and xylene degradation |
| PubChem Compound ID |
244 |
| SMILES |
C1=CC=C(C=C1)CO |
| Source File Reference |
bmse000407 |
