| SpectraBase Spectrum ID |
I5Hdkr8nWNe |
| Name |
Vestitenone |
| CAS Registry Number |
69401-36-1 |
| Copyright |
Database Compilation Copyright © 2023-2025 John Wiley and Sons, Inc. Copyright © 2023-2025 John Wiley and Sons, Inc., Portions Copyright Wiley-VCH GmbH, Adams Library under license from Diablo Analytical. All Rights Reserved. |
| Exact Mass |
178.135765199 u |
| Formula |
C12H18O |
| 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/C12H18O/c1-9-4-6-12(7-5-9)10(2)8-11(3)13/h4,8,12H,5-7H2,1-3H3/b10-8+ |
| InChIKey |
SSDLCRAPQKJETK-CSKARUKUSA-N |
| Molecular Weight |
178.275 g/mol |
| Nominal Mass |
178 u |
| Number of Peaks |
108 |
| SMILES |
CC(\C=C/(C)C1CC=C(CC1)C)=O |
| SPLASH |
splash10-00kg-9500000000-2c157e20571c71f414e5 |
| Source of Spectrum |
Adams' Essential Oil Components (GC-MS), Version 4 |
| Wiley ID |
RA002140 |
