| SpectraBase Spectrum ID |
CettHEqRIKv |
| Name |
Hexenol<3E-> |
| CAS Registry Number |
928-97-2 |
| 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 |
100.088815005 u |
| Formula |
C6H12O |
| 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/C6H12O/c1-2-3-4-5-6-7/h3-4,7H,2,5-6H2,1H3/b4-3+ |
| InChIKey |
UFLHIIWVXFIJGU-ONEGZZNKSA-N |
| Molecular Weight |
100.161 g/mol |
| Nominal Mass |
100 u |
| Number of Peaks |
39 |
| SMILES |
OCC\C=C\CC |
| SPLASH |
splash10-00kf-9000000000-8b2a109e0f610373d3ef |
| Source of Spectrum |
Adams' Essential Oil Components (GC-MS), Version 4 |
| Wiley ID |
RA001719 |
