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1-Hydroxy-1-[3,4-(methylenedioxy)phenyl]-2-butanone
SpectraBase Compound ID CXf1FBdA2TI
InChI InChI=1S/C11H12O4/c1-2-8(12)11(13)7-3-4-9-10(5-7)15-6-14-9/h3-5,11,13H,2,6H2,1H3
InChIKey NPVCMHYBDJPVRB-UHFFFAOYSA-N
Mol Weight 208.21 g/mol
Molecular Formula C11H12O4
Exact Mass 208.073559 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID C62ZhJBylbq
Name 1-Hydroxy-1-[3,4-(methylenedioxy)phenyl]-2-butanone
Alternate Name(s) 1-(1,3-benzodioxol-5-yl)-1-hydroxy-2-butanone
CAS Registry Number 99309-87-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H12O4
InChI InChI=1S/C11H12O4/c1-2-8(12)11(13)7-3-4-9-10(5-7)15-6-14-9/h3-5,11,13H,2,6H2,1H3
InChIKey NPVCMHYBDJPVRB-UHFFFAOYSA-N
Molecular Weight 208.213 g/mol
SMILES OC(c1cc2OCOc2cc1)C(=O)CC
SPLASH splash10-0f6t-4900000000-bf49262e4dc9465b7f7b
Source of Spectrum J-50-5312-5
Wiley ID 1206564