![(E)-1-[(1R)-2,6,6-trimethyl-1-cyclohex-2-enyl]-1-penten-3-one](/api/spectrum/5WrD2IB1fY0/structure.png?h=300&w=458 "(E)-1-[(1R)-2,6,6-trimethyl-1-cyclohex-2-enyl]-1-penten-3-one")
| SpectraBase Compound ID | 6zzG3OI5Qc2 |
|---|---|
| InChI | InChI=1S/C14H22O/c1-5-12(15)8-9-13-11(2)7-6-10-14(13,3)4/h7-9,13H,5-6,10H2,1-4H3/b9-8+/t13-/m0/s1 |
| InChIKey | VPKMGDRERYMTJX-XEHSLEBBSA-N |
| Mol Weight | 206.33 g/mol |
| Molecular Formula | C14H22O |
| Exact Mass | 206.167065 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 5WrD2IB1fY0 |
|---|---|
| Name | (E)-1-[(1R)-2,6,6-trimethyl-1-cyclohex-2-enyl]-1-penten-3-one |
| CAS Registry Number | 127-42-4 |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C14H22O |
| InChI | InChI=1S/C14H22O/c1-5-12(15)8-9-13-11(2)7-6-10-14(13,3)4/h7-9,13H,5-6,10H2,1-4H3/b9-8+/t13-/m0/s1 |
| InChIKey | VPKMGDRERYMTJX-XEHSLEBBSA-N |
| Molecular Weight | 206.329 g/mol |
| SMILES | [C@]1(\C=C\C(=O)CC)(C(=CCCC1(C)C)C)[H] |
| SPLASH | splash10-05fu-5920000000-949a2d055db30a1bee71 |
| Source of Spectrum | UT-1990-451-0 |
| Synonyms | .alpha.-N-Methyl ionone (E)-1-[(1R)-2,6,6-trimethylcyclohex-2-en-1-yl]pent-1-en-3-one (r-(E))-1-(2,6,6-trimethyl-2-cyclohexen-1-yl)pent-1-en-3-one 1-(2,6,6-Trimethyl-2-cyclohexen-1-yl)-1-penten-3-one 1-Penten-3-one, 1-((1R)-2,6,6-trimethyl-2-cyclohexen-1-yl)-, (1E)- 1-Penten-3-one, 1-(2,6,6-trimethyl-2-cyclohexen-1-yl)- 1-Penten-3-one, 1-(2,6,6-trimethyl-2-cyclohexen-1-yl)-, (theta-(E))- 5-(2,6,6-Trimethyl-2-cyclohexenyl)-4-penten-3-one EINECS 204-842-1 |
| Wiley ID | 1205136 |