| SpectraBase Spectrum ID |
IuTGQrIpril |
| Name |
1-Hexadecanol |
| Acquisition Mode |
SIMULTANEOUS |
| CAS Registry Number |
36653-82-4; 67762-30-5; 36311-34-9 |
| ChEBI ID |
16125 |
| Comments |
Saturated 1-Hexadecanol - Sigma-Aldrich
Solvent CDCl3, temperature 298 K |
| Copyright |
Database Compilation Copyright © 2021-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Data Source |
Madison Metabolomics Consortium |
| Formula |
C16 H34 O |
| IUPAC Name |
hexadecan-1-ol |
| InChI |
InChI=1S/C16H34O/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17/h17H,2-16H2,1H3 |
| InChIKey |
BXWNKGSJHAJOGX-UHFFFAOYSA-N |
| KEGG Compound ID |
C00823 |
| PubChem Compound ID |
2682 |
| SMILES |
CCCCCCCCCCCCCCCCO |
| Source File Reference |
bmse000487 |
