| SpectraBase Spectrum ID |
5kbXsMqeRdw |
| Name |
Isoamyl octanoate |
| CAS Registry Number |
2035-99-6 |
| Copyright |
Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C13H26O2 |
| GC Column |
J&W DB-5 (30 m x 0.25 mm ID x 0.25 ??m film thickness) |
| GC Oven Program |
60 ??C to 246 ??C at 3 ??C/min. |
| InChI |
InChI=1S/C13H26O2/c1-4-5-6-7-8-9-13(14)15-11-10-12(2)3/h12H,4-11H2,1-3H3 |
| InChIKey |
XKWSWANXMRXDES-UHFFFAOYSA-N |
| Molecular Weight |
214.349 g/mol |
| SMILES |
CCCCCCCC(OCCC(C)C)=O |
| SPLASH |
splash10-0596-9100000000-2cbe6159b4450bb2bf65 |
| Source |
ex ALDRICH |
| Source of Spectrum |
Adams' Essential Oil Components (GC-MS), Version 4 |
| Wiley ID |
1887536 |
