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Methyl 7-(3,5-dimethyl-4-hydroxyphenyl)-3-oxoheptanoate
SpectraBase Compound ID EhE8HOFII4v
InChI InChI=1S/C16H22O4/c1-11-8-13(9-12(2)16(11)19)6-4-5-7-14(17)10-15(18)20-3/h8-9,19H,4-7,10H2,1-3H3
InChIKey VWSYCXPJGGOCOG-UHFFFAOYSA-N
Mol Weight 278.35 g/mol
Molecular Formula C16H22O4
Exact Mass 278.151809 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 40jQeg6G4Sd
Name Methyl 7-(3,5-dimethyl-4-hydroxyphenyl)-3-oxoheptanoate
Alternate Name(s) Methyl 7-(4-hydroxy-3,5-dimethylphenyl)-3-oxoheptanoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H22O4
InChI InChI=1S/C16H22O4/c1-11-8-13(9-12(2)16(11)19)6-4-5-7-14(17)10-15(18)20-3/h8-9,19H,4-7,10H2,1-3H3
InChIKey VWSYCXPJGGOCOG-UHFFFAOYSA-N
Molecular Weight 278.348 g/mol
SMILES Oc1c(cc(cc1C)CCCCC(CC(=O)OC)=O)C
SPLASH splash10-000i-0960000000-ecb74a59b0da0b14a9b8
Source of Spectrum J-59-6331-15
Wiley ID 1282116