| SpectraBase Spectrum ID |
FmTKU6k1Oa9 |
| Name |
Ionone<6-methyl-alpha-> |
| CAS Registry Number |
79-69-6 |
| 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 |
206.167065327 u |
| Formula |
C14H22O |
| 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/C14H22O/c1-10-6-7-11(2)14(4,5)13(10)9-8-12(3)15/h6,8-9,11,13H,7H2,1-5H3/b9-8+ |
| InChIKey |
JZQOJFLIJNRDHK-CMDGGOBGSA-N |
| Molecular Weight |
206.329 g/mol |
| Nominal Mass |
206 u |
| Number of Peaks |
149 |
| SMILES |
C(\C=C\C1C(C)(C)C(C)CC=C1C)(C)=O |
| SPLASH |
splash10-006x-9800000000-a519c9b94d363bf12f9a |
| Source of Spectrum |
Adams' Essential Oil Components (GC-MS), Version 4 |
| Wiley ID |
RA001761 |
