| SpectraBase Spectrum ID |
7Rnk1ggbspz |
| Name |
Celestolide |
| CAS Registry Number |
13171-00-1 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C17H24O |
| 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/C17H24O/c1-11(18)14-9-12(16(2,3)4)10-15-13(14)7-8-17(15,5)6/h9-10H,7-8H2,1-6H3 |
| InChIKey |
IKTHMQYJOWTSJO-UHFFFAOYSA-N |
| Molecular Weight |
244.378 g/mol |
| SMILES |
c12c(cc(cc2C(C)(C)CC1)C(C)(C)C)C(=O)C |
| SPLASH |
splash10-0006-9540000000-50265304bcfb341e7382 |
| Source of Spectrum |
Adams' Essential Oil Components (GC-MS), Version 4 |
| Wiley ID |
1886078 |
