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Parahigginol A - diacetate
SpectraBase Compound ID ATghpNYvA4N
InChI InChI=1S/C19H28O4/c1-12(2)9-17(22-15(5)20)11-14(4)18-8-7-13(3)10-19(18)23-16(6)21/h7-8,10,12,14,17H,9,11H2,1-6H3
InChIKey FYGVVIXRKXJPHV-UHFFFAOYSA-N
Mol Weight 320.43 g/mol
Molecular Formula C19H28O4
Exact Mass 320.198759 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1dRNueJsnAC
Name Parahigginol A - diacetate
Alternate Name(s) 2-[3-(acetyloxy)-1,5-dimethylhexyl]-5-methylphenyl acetate 6-[1',5'-Dimethyl-3'-acetoxyhexyl]-3-methyl-1-acetoxybenzene Acetic acid[2-(3-acetoxy-1,5-dimethyl-hexyl)-5-methyl-phenyl]ester Acetic acid[2-(4-acetyloxy-6-methylheptan-2-yl)-5-methylphenyl]ester [2-(3-acetoxy-1,5-dimethyl-hexyl)-5-methyl-phenyl]acetate [2-(4-acetyloxy-6-methyl-heptan-2-yl)-5-methyl-phenyl]ethanoate [2-(4-acetyloxy-6-methylheptan-2-yl)-5-methylphenyl]acetate Acetic acid [2-(4-acetyloxy-6-methylheptan-2-yl)-5-methylphenyl] ester [2-(4-acetyloxy-6-methylheptan-2-yl)-5-methylphenyl] acetate [2-(3-acetoxy-1,5-dimethyl-hexyl)-5-methyl-phenyl] acetate [2-(4-acetyloxy-6-methyl-heptan-2-yl)-5-methyl-phenyl] ethanoate
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Formula C19H28O4
InChI InChI=1S/C19H28O4/c1-12(2)9-17(22-15(5)20)11-14(4)18-8-7-13(3)10-19(18)23-16(6)21/h7-8,10,12,14,17H,9,11H2,1-6H3
InChIKey FYGVVIXRKXJPHV-UHFFFAOYSA-N
Molecular Weight 320.429 g/mol
SMILES c1(c(C(CC(OC(=O)C)CC(C)C)C)ccc(c1)C)OC(=O)C
SPLASH splash10-00ku-3940000000-240228ff6f4e0a65af2a
Source of Spectrum G4-62-575-6
Wiley ID 1607826