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Ethyl 4-(4-Hydroxy-3-oxobutyl)benzoate

View entire compound with spectra: 1 MS (GC)

Ethyl 4-(4-Hydroxy-3-oxobutyl)benzoate
SpectraBase Compound ID Cs4fEMaBIw8
InChI InChI=1S/C13H16O4/c1-2-17-13(16)11-6-3-10(4-7-11)5-8-12(15)9-14/h3-4,6-7,14H,2,5,8-9H2,1H3
InChIKey FYKFIWNMJRCALR-UHFFFAOYSA-N
Mol Weight 236.27 g/mol
Molecular Formula C13H16O4
Exact Mass 236.104859 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KpvpYh5XXwx
Name Ethyl 4-(4-Hydroxy-3-oxobutyl)benzoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H16O4
InChI InChI=1S/C13H16O4/c1-2-17-13(16)11-6-3-10(4-7-11)5-8-12(15)9-14/h3-4,6-7,14H,2,5,8-9H2,1H3
InChIKey FYKFIWNMJRCALR-UHFFFAOYSA-N
Molecular Weight 236.267 g/mol
SMILES OCC(=O)CCc1ccc(C(=O)OCC)cc1
SPLASH splash10-08iu-0910000000-2adc1471cfef182fc946
Source of Spectrum J-60-6686-6
Synonyms 4-(4-hydroxy-3-keto-butyl)benzoic acid ethyl ester 4-(4-hydroxy-3-oxobutyl)benzoic acid ethyl ester Ethyl 4-(4-oxidanyl-3-oxidanylidene-butyl)benzoate
Wiley ID 1238139