| SpectraBase Spectrum ID |
1Vf65trojg |
| Name |
Atlantone<(E)-alpha-> |
| CAS Registry Number |
108645-54-1 |
| 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 |
218.167065327 u |
| Formula |
C15H22O |
| 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/C15H22O/c1-11(2)9-15(16)10-13(4)14-7-5-12(3)6-8-14/h5,9-10,14H,6-8H2,1-4H3/b13-10+ |
| InChIKey |
OJEFBZMKKJTKKK-JLHYYAGUSA-N |
| Molecular Weight |
218.340 g/mol |
| Nominal Mass |
218 u |
| Number of Peaks |
170 |
| SMILES |
CC(=CC(\C=C/(C)C1CC=C(CC1)C)=O)C |
| SPLASH |
splash10-0540-9710000000-d60aa1802c34df3c81ef |
| Source of Spectrum |
Adams' Essential Oil Components (GC-MS), Version 4 |
| Wiley ID |
RA001440 |
