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(R)- and (S)-4-(3',4'-Dimethoxyphenyl)-3-methyl-2-butanone
SpectraBase Compound ID C0ggu0yEC5p
InChI InChI=1S/C13H18O3/c1-9(10(2)14)7-11-5-6-12(15-3)13(8-11)16-4/h5-6,8-9H,7H2,1-4H3
InChIKey WCNQEKBOFSDJMH-UHFFFAOYSA-N
Mol Weight 222.28 g/mol
Molecular Formula C13H18O3
Exact Mass 222.125594 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AYjsI1vAcKc
Name (R)- and (S)-4-(3',4'-Dimethoxyphenyl)-3-methyl-2-butanone
Alternate Name(s) 4-(3,4-dimethoxyphenyl)-3-methylbutan-2-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H18O3
InChI InChI=1S/C13H18O3/c1-9(10(2)14)7-11-5-6-12(15-3)13(8-11)16-4/h5-6,8-9H,7H2,1-4H3
InChIKey WCNQEKBOFSDJMH-UHFFFAOYSA-N
Molecular Weight 222.284 g/mol
SMILES c1(cc(ccc1OC)CC(C(C)=O)C)OC
SPLASH splash10-0udi-0920000000-c6aa009e97b975efe57b
Source of Spectrum ASC-358-3566-(R)/(S)_6i
Wiley ID 1803405