| SpectraBase Compound ID | 57F2QZP1bgX |
|---|---|
| InChI | InChI=1S/C13H22O/c1-10-6-5-9-13(3,4)12(10)8-7-11(2)14/h6,12H,5,7-9H2,1-4H3 |
| InChIKey | JHJCHCSUEGPIGE-UHFFFAOYSA-N |
| Mol Weight | 194.32 g/mol |
| Molecular Formula | C13H22O |
| Exact Mass | 194.167065 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | B4T3jstAPEO |
|---|---|
| Name | 2-Butanone, 4-(2,6,6-trimethyl-2-cyclohexen-1-yl)- |
| CAS Registry Number | 31499-72-6 |
| Copyright | Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C13H22O |
| InChI | InChI=1S/C13H22O/c1-10-6-5-9-13(3,4)12(10)8-7-11(2)14/h6,12H,5,7-9H2,1-4H3 |
| InChIKey | JHJCHCSUEGPIGE-UHFFFAOYSA-N |
| Molecular Weight | 194.318 g/mol |
| SMILES | C=1CCC(C(C1C)CCC(=O)C)(C)C |
| SPLASH | splash10-0006-9400000000-c989537a2088d1f97ccd |
| Source of Spectrum | XW-409-0-0 |
| Synonyms | (+)-Dihydro-.alpha.-ionone .alpha.-Dihydroionone 1,5,5-Trimethyl-6-(3-oxobutyl)cyclohexene 2-Butanone, 4-(2,6,6-trimethyl-2-cyclohexen-1-yl)-, (R)- 2',2''-Dihydro-.alpha.-ionone 3,4-Dihydro-.alpha.-ionone 4-(2,6,6-Trimethyl-2-cyclohexen-1-yl)-2-butanone 4-(2,2,6-Trimethyl-5-cyclohexen-1-yl)-2-butanone 4-(2,6,6-trimethyl-1-cyclohex-2-enyl)-2-butanone 4-(2,6,6-Trimethyl-2-cyclohexen-1-yl)butan-2-one 4-(2,6,6-Trimethylcyclohex-2-en-1-yl)-2-butanone 4-(2,6,6-trimethylcyclohex-2-en-1-yl)butan-2-one Dihydro-.alpha.-ionone AI3-32481 EINECS 250-657-4 FEMA NO. 3628 |
| Wiley ID | 1191371 |