| SpectraBase Spectrum ID |
1OnGid3fLa2 |
| Name |
Ternine |
| CAS Registry Number |
116964-00-2 |
| 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 |
204.115029753 u |
| Formula |
C13H16O2 |
| 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/C13H16O2/c1-2-3-4-9-12-10-7-5-6-8-11(10)13(14)15-12/h6,8-9H,2-5,7H2,1H3/b12-9- |
| InChIKey |
HMAYXYFQOZZPEZ-XFXZXTDPSA-N |
| Molecular Weight |
204.269 g/mol |
| Nominal Mass |
204 u |
| Number of Peaks |
116 |
| SMILES |
C1(O\C(=C/CCCC)C2=C1C=CCC2)=O |
| SPLASH |
splash10-0a4i-8900000000-58be8005bb2f6b073ba4 |
| Source of Spectrum |
Adams' Essential Oil Components (GC-MS), Version 4 |
| Wiley ID |
RA002067 |
