(6S)-Dehydrovomifoliol
Properties
Property | Value |
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Formula | C13H18O3 |
IUPAC Name | (4s)-4-hydroxy-3,5,5-trimethyl-4-[(e)-3-oxobut-1-enyl]cyclohex-2-en-1-one |
Molecular Mass | 222.280 g·mol−1 |
Heat of Formation | -521.1 ± 16.7 kJ·mol−1 |
Dipole Moment | 5.33 ± 1.08 D |
Volume | 287.97 Å 3 |
Surface Area | 252.12 Å 2 |
HOMO Energy | -10.04 ± 0.55 eV |
LUMO Energy | -0.53 ± eV |
Point Group Symmetry | C1 |
Synonyms |
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CAS Number(s) |
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InChIKey | JJRYPZMXNLLZFH-URWSZGRFSA-N |
QR Code | Generate QR Code |
Links | PubChem ChemSpider |
DOI | |
Downloads | Get JSON data Get MOL2 data Get SVG Image |
Elements | H C O |