| SpectraBase Spectrum ID |
1pcjIZx0Vc |
| Name |
Isopentyl alcohol |
| CAS Registry Number |
123-51-3 |
| 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 |
88.088815005 u |
| Formula |
C5H12O |
| 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/C5H12O/c1-5(2)3-4-6/h5-6H,3-4H2,1-2H3 |
| InChIKey |
PHTQWCKDNZKARW-UHFFFAOYSA-N |
| Molecular Weight |
88.150 g/mol |
| Nominal Mass |
88 u |
| Number of Peaks |
47 |
| SMILES |
OCCC(C)C |
| SPLASH |
splash10-052f-9000000000-881ab0982193d4f46d7b |
| Source of Spectrum |
Adams' Essential Oil Components (GC-MS), Version 4 |
| Wiley ID |
RA001791 |
