| SpectraBase Spectrum ID |
4G7gjUc2lwP |
| Name |
Ionone <(E)-, beta-> |
| CAS Registry Number |
79-77-6 |
| 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 |
192.151415263 u |
| Formula |
C13H20O |
| 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 |
| Number of Peaks |
50 |
| RI1 |
1490 |
| RI2 |
1168 |
| SMILES |
CC(\C=C\C1=C(CCCC1(C)C)C)=O |
| SPLASH |
splash10-004l-7900000000-5cfb1a7403b016a57a73 |
| Sample Comments |
RI1: measured on SLB-5ms (Hydro)
RI2: measured on SLB-5ms (FAMEs)
RI3: measured on Supelcowax-10 (FAMEs)
RI4: measured on Supelcowax-10 (FAEEs)
RI5: measured on Equity-1 (Hydro) |
| Source of Spectrum |
Prof. L. Mondello (Chromaleont s.r.l./Univ. Messina, Italy) |
| Synonyms |
3-Buten-2-one, 4-(2,6,6-trimethyl-1-cyclohexen-1-yl)-, (3E)- |
| Wiley ID |
LM_FFNSC3_977 |
