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Methyl 4-[(3',7'-dimethyl-5'-oxo-3'-octyl)oxy]-3-hydroxybenzoate
SpectraBase Compound ID BOVVXp9Dnkz
InChI InChI=1S/C18H26O5/c1-6-18(4,11-14(19)9-12(2)3)23-16-8-7-13(10-15(16)20)17(21)22-5/h7-8,10,12,20H,6,9,11H2,1-5H3
InChIKey QUUQJQSDULKYFC-UHFFFAOYSA-N
Mol Weight 322.4 g/mol
Molecular Formula C18H26O5
Exact Mass 322.178024 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID L7tYonuhctL
Name Methyl 4-[(3',7'-dimethyl-5'-oxo-3'-octyl)oxy]-3-hydroxybenzoate
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Formula C18H26O5
InChI InChI=1S/C18H26O5/c1-6-18(4,11-14(19)9-12(2)3)23-16-8-7-13(10-15(16)20)17(21)22-5/h7-8,10,12,20H,6,9,11H2,1-5H3
InChIKey QUUQJQSDULKYFC-UHFFFAOYSA-N
Molecular Weight 322.401 g/mol
SMILES Oc1cc(C(=O)OC)ccc1OC(CC(=O)CC(C)C)(CC)C
SPLASH splash10-0a4i-2900000000-1dab18e8b93cb2e8e1e3
Source of Spectrum G4-61-128-9
Synonyms Methyl 4-[(1-ethyl-1,5-dimethyl-3-oxohexyl)oxy]-3-hydroxybenzoate
Wiley ID 1607068