SpectraBase Spectrum ID |
DomYNg0KZxK |
Name |
Linalool butanoate |
CAS Registry Number |
78-36-4 |
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 |
224.177630011 u |
Formula |
C14H24O2 |
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/C14H24O2/c1-6-9-13(15)16-14(5,7-2)11-8-10-12(3)4/h7,10H,2,6,8-9,11H2,1,3-5H3 |
InChIKey |
FHLGUOHLUFIAAA-UHFFFAOYSA-N |
Molecular Weight |
224.344 g/mol |
Nominal Mass |
224 u |
Number of Peaks |
106 |
SMILES |
C(OC(CCC)=O)(C)(CCC=C(C)C)C=C |
SPLASH |
splash10-0006-9000000000-68edaecbd3abe8ed5480 |
Source of Spectrum |
Adams' Essential Oil Components (GC-MS), Version 4 |
Wiley ID |
RA001825 |