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4-(3,4-Methylenedioxyphenyl)-2-butanone

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4-(3,4-Methylenedioxyphenyl)-2-butanone
SpectraBase Compound ID 6hHDoLfJjyu
InChI InChI=1S/C11H12O3/c1-8(12)2-3-9-4-5-10-11(6-9)14-7-13-10/h4-6H,2-3,7H2,1H3
InChIKey TZJLGGWGVLADDN-UHFFFAOYSA-N
Mol Weight 192.21 g/mol
Molecular Formula C11H12O3
Exact Mass 192.078644 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4hRSe2O04e
Name 3,4-Methylenedioxybenzylacetone
Alternate Name(s) 2-Butanone, 4-[1,3-benzodioxol-5-yl]- 4-(1,3-Benzodioxol-5-yl)-2-butanone 4-(1,3-benzodioxol-5-yl)butan-2-one 4-(3,4-Methylenedioxyphenyl)-2-butanone
CAS Registry Number 55418-52-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H12O3
InChI InChI=1S/C11H12O3/c1-8(12)2-3-9-4-5-10-11(6-9)14-7-13-10/h4-6H,2-3,7H2,1H3
InChIKey TZJLGGWGVLADDN-UHFFFAOYSA-N
Molecular Weight 192.214 g/mol
SMILES c12c(OCO2)ccc(c1)CCC(=O)C
SPLASH splash10-000f-2900000000-821529c06d3259ed8486
Wiley ID 1448673