SpectraBase Spectrum ID |
2R1xiywC6Xf |
Name |
Sabina ketone |
CAS Registry Number |
513-20-2 |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C9H14O |
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/C9H14O/c1-6(2)9-4-3-8(10)7(9)5-9/h6-7H,3-5H2,1-2H3 |
InChIKey |
MDDYCNAAAZKNAJ-UHFFFAOYSA-N |
Molecular Weight |
138.210 g/mol |
SMILES |
CC(C)C12C(C(=O)CC2)C1 |
SPLASH |
splash10-05ng-9000000000-14448f95dad6d2ba8f1b |
Source of Spectrum |
Adams' Essential Oil Components (GC-MS), Version 4 |
Wiley ID |
1887810 |