| SpectraBase Spectrum ID |
BboY9J8T6D8 |
| Name |
Ionone |
| Source of Sample |
SAFC Cat.no. S409294 |
| CAS Registry Number |
127-51-5 |
| 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 |
| InChI |
InChI=1S/C14H22O/c1-10-7-6-8-14(4,5)13(10)9-11(2)12(3)15/h7,9,13H,6,8H2,1-5H3/b11-9+ |
| InChIKey |
JRJBVWJSTHECJK-PKNBQFBNSA-N |
| Molecular Weight |
206.329 g/mol |
| Number of Peaks |
50 |
| RI1 |
1473 |
| RI2 |
1151 |
| RI3 |
1248 |
| RI4 |
1206 |
| SMILES |
C1C=C(C(C(C1)(C)C)\C=C/(C)C(C)=O)C |
| SPLASH |
splash10-0pbl-4900000000-35ecdf569705d7e5785c |
| 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, 3-methyl-4-(2,6,6-trimethyl-2-cyclohexen-1-yl)- |
| Wiley ID |
LM_FFNSC3_1142 |
