| SpectraBase Spectrum ID |
9CCG3Gh75TO |
| Name |
(E)-.alpha.-Ionone |
| CAS Registry Number |
127-41-3 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C13H20O |
| GC Column |
J&W DB-5 (30 m x 0.25 mm ID x 0.25 ??m film thickness) |
| GC Oven Program |
60 ??C to 246 ??C at 3 ??C/min. |
| InChI |
InChI=1S/C13H20O/c1-10-6-5-9-13(3,4)12(10)8-7-11(2)14/h6-8,12H,5,9H2,1-4H3/b8-7+ |
| InChIKey |
UZFLPKAIBPNNCA-BQYQJAHWSA-N |
| Molecular Weight |
192.302 g/mol |
| SMILES |
C1CC(C(C(=C1)C)\C=C\C(C)=O)(C)C |
| SPLASH |
splash10-0006-9800000000-14424e868496482be9c8 |
| Source of Spectrum |
Adams' Essential Oil Components (GC-MS), Version 4 |
| Synonyms |
Ionone<(E)-.alpha.-> |
| Wiley ID |
1887526 |
