| SpectraBase Spectrum ID |
CzU4IIdQ4r5 |
| Name |
Methyl-2-butanol<3-> |
| CAS Registry Number |
598-75-4 |
| 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/c1-4(2)5(3)6/h4-6H,1-3H3 |
| InChIKey |
MXLMTQWGSQIYOW-UHFFFAOYSA-N |
| Molecular Weight |
88.150 g/mol |
| Nominal Mass |
88 u |
| Number of Peaks |
31 |
| SMILES |
OC(C(C)C)C |
| SPLASH |
splash10-0002-9000000000-d070c0e2680e19248254 |
| Source |
ex ALDRICH |
| Source of Spectrum |
Adams' Essential Oil Components (GC-MS), Version 4 |
| Wiley ID |
RA001857 |
