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4-[2-(4-hydroxyphenyl)ethyl]-3-keto-enanthic acid methyl ester
SpectraBase Compound ID HgIYZJjYhYX
InChI InChI=1S/C16H22O4/c1-3-4-13(15(18)11-16(19)20-2)8-5-12-6-9-14(17)10-7-12/h6-7,9-10,13,17H,3-5,8,11H2,1-2H3
InChIKey MTPWMCSGLURYTM-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 D8bLGmtKoYB
Name 4-[2-(4-hydroxyphenyl)ethyl]-3-keto-enanthic acid methyl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H22O4
InChI InChI=1S/C16H22O4/c1-3-4-13(15(18)11-16(19)20-2)8-5-12-6-9-14(17)10-7-12/h6-7,9-10,13,17H,3-5,8,11H2,1-2H3
InChIKey MTPWMCSGLURYTM-UHFFFAOYSA-N
Molecular Weight 278.348 g/mol
SMILES Oc1ccc(CCC(C(CC(=O)OC)=O)CCC)cc1
SPLASH splash10-0adi-0900000000-939577ff0be0e4a9adb3
Source of Spectrum J-63-1859-11
Synonyms 4-[2-(4-hydroxyphenyl)ethyl]-3-oxoheptanoic acid methyl ester Methyl 4-[2-(4-hydroxyphenyl)ethyl]-3-oxidanylidene-heptanoate Methyl 4-[2-(4-hydroxyphenyl)ethyl]-3-oxo-heptanoate
Wiley ID 1282119