SpectraBase Spectrum ID |
HhxcO11eOdu |
Name |
Terpinyl acetate |
CAS Registry Number |
20777-40-6 |
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 |
198.161979946 u |
Formula |
C12H22O2 |
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/C12H22O2/c1-9-5-7-11(8-6-9)12(3,4)14-10(2)13/h9,11H,5-8H2,1-4H3/t9-,11+ |
InChIKey |
HBNHCGDYYBMKJN-JGZJWPJOSA-N |
Molecular Weight |
198.306 g/mol |
Nominal Mass |
198 u |
Number of Peaks |
88 |
SMILES |
CC(=O)OC([C@]1(CC[C@](CC1)(C)[H])[H])(C)C |
SPLASH |
splash10-0006-9100000000-fe5ede4f0d9cbdda347f |
Source of Spectrum |
Adams' Essential Oil Components (GC-MS), Version 4 |
Wiley ID |
RA001301 |