SpectraBase Spectrum ID |
DVGAJDvg2HZ |
Name |
Isobutyl hexanoate |
CAS Registry Number |
105-79-3 |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C10H20O2 |
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/C10H20O2/c1-4-5-6-7-10(11)12-8-9(2)3/h9H,4-8H2,1-3H3 |
InChIKey |
UXUPPWPIGVTVQI-UHFFFAOYSA-N |
Molecular Weight |
172.268 g/mol |
SMILES |
C(OCC(C)C)(CCCCC)=O |
SPLASH |
splash10-052g-9100000000-449ec9264ade105536fd |
Source |
ex ALDRICH |
Source of Spectrum |
Adams' Essential Oil Components (GC-MS), Version 4 |
Wiley ID |
1887544 |