| SpectraBase Spectrum ID |
7lftAcLDI2I |
| Name |
Ionone |
| CAS Registry Number |
55093-42-0 |
| 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 |
206.167065327 u |
| Formula |
C14H22O |
| InChI |
InChI=1S/C14H22O/c1-10-7-6-8-14(4,5)13(10)9-11(2)12(3)15/h7,9,11H,6,8H2,1-5H3/b13-9- |
| InChIKey |
IMZDLYVLBCBNQV-LCYFTJDESA-N |
| Molecular Weight |
206.329 g/mol |
| Number of Peaks |
50 |
| RI1 |
1478 |
| RI2 |
1157 |
| RI3 |
1237 |
| RI4 |
1195 |
| SMILES |
C1(\C(C(=CCC1)C)=C/C(C(C)=O)C)(C)C |
| SPLASH |
splash10-0k9f-6900000000-99298de74b3c86a56d84 |
| 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 |
2-Butanone, 3-methyl-4-(2,6,6-trimethyl-2-cyclohexen-1-ylidene)-, (E)- |
| Wiley ID |
LM_FFNSC3_2364 |
