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3-Buten-2-one, 4-(4,7-dimethoxy-1,3-benzodioxol-5-yl)-,
SpectraBase Compound ID 1DZ3IUEcwsX
InChI InChI=1S/C13H14O5/c1-8(14)4-5-9-6-10(15-2)12-13(11(9)16-3)18-7-17-12/h4-6H,7H2,1-3H3/b5-4+
InChIKey HAJKZCUIPDKNQA-SNAWJCMRSA-N
Mol Weight 250.25 g/mol
Molecular Formula C13H14O5
Exact Mass 250.084124 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1HSndubVGit
Name 3-Buten-2-one, 4-(4,7-dimethoxy-1,3-benzodioxol-5-yl)-,
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H14O5
InChI InChI=1S/C13H14O5/c1-8(14)4-5-9-6-10(15-2)12-13(11(9)16-3)18-7-17-12/h4-6H,7H2,1-3H3/b5-4+
InChIKey HAJKZCUIPDKNQA-SNAWJCMRSA-N
Molecular Weight 250.250 g/mol
SMILES c12c(c(c(cc2OC)\C=C\C(C)=O)OC)OCO1
SPLASH splash10-0gdl-9540000000-690dc8594d906d45e96a
Source of Spectrum IY-2-4945-4
Synonyms (E)-4-(4,7-dimethoxy-1,3-benzodioxol-5-yl)-3-buten-2-one
Wiley ID 1657437