| SpectraBase Spectrum ID |
6fsmqKlLau2 |
| Name |
Methyl pentanoate<2-hydroxy-3-methyl-> |
| CAS Registry Number |
41654-19-7 |
| 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 |
146.094294308 u |
| Formula |
C7H14O3 |
| 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/C7H14O3/c1-4-5(2)6(8)7(9)10-3/h5-6,8H,4H2,1-3H3 |
| InChIKey |
OQXGUAUSWWFHOM-UHFFFAOYSA-N |
| Molecular Weight |
146.186 g/mol |
| Nominal Mass |
146 u |
| Number of Peaks |
89 |
| SMILES |
OC(C(CC)C)C(OC)=O |
| SPLASH |
splash10-0007-9000000000-da584ebc73f6084a6fe8 |
| Source of Spectrum |
Adams' Essential Oil Components (GC-MS), Version 4 |
| Wiley ID |
RA001898 |
