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(E)-4-(3',4'-Dimethoxyphenyl)-3-hydroxymethyl-3-buten-2-one
SpectraBase Compound ID H1JzrYbZYMe
InChI InChI=1S/C13H16O4/c1-9(15)11(8-14)6-10-4-5-12(16-2)13(7-10)17-3/h4-7,14H,8H2,1-3H3/b11-6+
InChIKey VNIPLPLVPSLKOP-IZZDOVSWSA-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 F9mdJiCNkmG
Name (E)-4-(3',4'-Dimethoxyphenyl)-3-hydroxymethyl-3-buten-2-one
Alternate Name(s) (E)-4-(3,4-dimethoxyphenyl)-3-(hydroxymethyl)but-3-en-2-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H16O4
InChI InChI=1S/C13H16O4/c1-9(15)11(8-14)6-10-4-5-12(16-2)13(7-10)17-3/h4-7,14H,8H2,1-3H3/b11-6+
InChIKey VNIPLPLVPSLKOP-IZZDOVSWSA-N
Literature Reference DOI 10.1002/adsc.201600601
Molecular Weight 236.267 g/mol
SMILES OC\C(C(C)=O)=C/c1cc(c(cc1)OC)OC
SPLASH splash10-002r-1930000000-ebaf1d78b0ee5b38e637
Source of Spectrum ASC-358-3564-4i
Wiley ID 1803435