| SpectraBase Spectrum ID |
BNkj2BhzC4l |
| Name |
(E)-.beta.-Ionone |
| Alternate Name(s) |
Ionone<(E)-.beta.-> |
| CAS Registry Number |
79-77-6 |
| 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/h7-8H,5-6,9H2,1-4H3/b8-7+ |
| InChIKey |
PSQYTAPXSHCGMF-BQYQJAHWSA-N |
| Molecular Weight |
192.302 g/mol |
| SMILES |
C(\C=C\C=1C(C)(C)CCCC1C)(C)=O |
| SPLASH |
splash10-004l-5900000000-b8bb0caa0dc7703b398a |
| Source of Spectrum |
Adams' Essential Oil Components (GC-MS), Version 4 |
| Wiley ID |
1887527 |
