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(R)- and (S)-3-Methyl-4-(3',4'-methylenedioxyphenyl)-2-butanone
SpectraBase Compound ID Eb3hpofwl78
InChI InChI=1S/C12H14O3/c1-8(9(2)13)5-10-3-4-11-12(6-10)15-7-14-11/h3-4,6,8H,5,7H2,1-2H3
InChIKey UKZGDVKMPYZURA-UHFFFAOYSA-N
Mol Weight 206.24 g/mol
Molecular Formula C12H14O3
Exact Mass 206.094294 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Ba2zYg8lBJu
Name (R)- and (S)-3-Methyl-4-(3',4'-methylenedioxyphenyl)-2-butanone
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H14O3
InChI InChI=1S/C12H14O3/c1-8(9(2)13)5-10-3-4-11-12(6-10)15-7-14-11/h3-4,6,8H,5,7H2,1-2H3
InChIKey UKZGDVKMPYZURA-UHFFFAOYSA-N
Literature Reference DOI 10.1002/adsc.201600601
Molecular Weight 206.241 g/mol
SMILES c12cc(ccc2OCO1)CC(C(C)=O)C
SPLASH splash10-000i-0920000000-f7dd8784217c4eb9d181
Source of Spectrum ASC-358-3566-(R)/(S)_6j
Synonyms 4-(benzo[d][1,3]dioxol-5-yl)-3-methylbutan-2-one
Wiley ID 1803406