| SpectraBase Spectrum ID |
7oRcb8grVPj |
| Name |
Hexanol |
| CAS Registry Number |
111-27-3 |
| Copyright |
Database Compilation Copyright © 2023-2024 John Wiley and Sons, Inc. Copyright © 2023-2024 John Wiley and Sons, Inc., Portions Copyright Wiley-VCH GmbH, Adams Library under license from Diablo Analytical. All Rights Reserved. |
| Exact Mass |
102.104465070 u |
| Formula |
C6H14O |
| GC Column |
J&W DB-5 (30 m x 0.25 mm ID x 0.25 μm film thickness) |
| GC Oven Program |
60 °C to 246 °C at 3 °C/min. |
| InChI |
InChI=1S/C6H14O/c1-2-3-4-5-6-7/h7H,2-6H2,1H3 |
| InChIKey |
ZSIAUFGUXNUGDI-UHFFFAOYSA-N |
| Molecular Weight |
102.177 g/mol |
| Nominal Mass |
102 u |
| Number of Peaks |
53 |
| SMILES |
OCCCCCC |
| SPLASH |
splash10-052f-9000000000-af2ff8e06f811c4bb5bd |
| Source of Spectrum |
Adams' Essential Oil Components (GC-MS), Version 4 |
| Wiley ID |
RA001711 |
