| SpectraBase Spectrum ID |
3IGiHzqSsmr |
| Name |
Hedycaryol |
| CAS Registry Number |
21657-90-9 |
| 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 |
222.198365456 u |
| Formula |
C15H26O |
| 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/C15H26O/c1-12-6-5-7-13(2)9-11-14(10-8-12)15(3,4)16/h6,9,14,16H,5,7-8,10-11H2,1-4H3/b12-6-,13-9-/t14-/m0/s1 |
| InChIKey |
SDMLCXJKAYFHQM-LIJSYYTGSA-N |
| Molecular Weight |
222.372 g/mol |
| Nominal Mass |
222 u |
| Number of Peaks |
89 |
| SMILES |
OC([C@@]1(C\C=C/(CC\C=C/(CC1)C)C)[H])(C)C |
| SPLASH |
splash10-0a4l-9400000000-f1a21d281724162cc7ec |
| Source |
ex IAN SOUTHWELL |
| Source of Spectrum |
Adams' Essential Oil Components (GC-MS), Version 4 |
| Wiley ID |
RA001662 |
