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2-Butanone, 3-(2,3-dimethylphenyl)-
SpectraBase Compound ID IFMtoQBpOPT
InChI InChI=1S/C12H16O/c1-8-6-5-7-12(9(8)2)10(3)11(4)13/h5-7,10H,1-4H3
InChIKey WVMRQFYQZQVEHU-UHFFFAOYSA-N
Mol Weight 176.26 g/mol
Molecular Formula C12H16O
Exact Mass 176.120115 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8UkRPNxUp9q
Name 2-Butanone, 3-(2,3-dimethylphenyl)-
CAS Registry Number 64394-33-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H16O
InChI InChI=1S/C12H16O/c1-8-6-5-7-12(9(8)2)10(3)11(4)13/h5-7,10H,1-4H3
InChIKey WVMRQFYQZQVEHU-UHFFFAOYSA-N
Molecular Weight 176.259 g/mol
SMILES c1(c(c(C)ccc1)C)C(C(=O)C)C
SPLASH splash10-001i-0900000000-260950876dcf06bf3584
Source of Spectrum H-60-1775-0
Synonyms 3-(2,3-Dimethylphenyl)-2-butanone 3-(2,3-Dimethylphenyl)-2-butanone and-3-(3,4-dimethylphenyl)-2-butanone
Wiley ID 1172624