![acetic acid [4-[(E)-3-ketobut-1-enyl]-3,5,5-trimethyl-1-cyclohex-3-enyl] ester](/api/spectrum/FsTqtWixyY0/structure.png?h=300&w=458 "acetic acid [4-[(E)-3-ketobut-1-enyl]-3,5,5-trimethyl-1-cyclohex-3-enyl] ester")
| SpectraBase Compound ID | 9umDz4lbTqG |
|---|---|
| InChI | InChI=1S/C15H22O3/c1-10-8-13(18-12(3)17)9-15(4,5)14(10)7-6-11(2)16/h6-7,13H,8-9H2,1-5H3/b7-6+ |
| InChIKey | YABVVCNXDNIHRP-VOTSOKGWSA-N |
| Mol Weight | 250.34 g/mol |
| Molecular Formula | C15H22O3 |
| Exact Mass | 250.156895 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | FsTqtWixyY0 |
|---|---|
| Name | 3-BUTEN-2-ONE, 4-[4-(ACETYLOXY)-2,6,6-TRIMETHYL-1-CYCLOHEXEN-1-YL]- |
| Copyright | Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula | C15H22O3 |
| InChI | InChI=1S/C15H22O3/c1-10-8-13(18-12(3)17)9-15(4,5)14(10)7-6-11(2)16/h6-7,13H,8-9H2,1-5H3/b7-6+ |
| InChIKey | YABVVCNXDNIHRP-VOTSOKGWSA-N |
| Instrument Name | BRUKER HX-90 |
| NMR Standard | TMS |
| Solvent | CDCL3 |