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1,2-bis(3'-Methylphenyl)-etanone
SpectraBase Compound ID 1kY0PTA3PTN
InChI InChI=1S/C16H16O/c1-12-5-3-7-14(9-12)11-16(17)15-8-4-6-13(2)10-15/h3-10H,11H2,1-2H3
InChIKey RKAQGCQFDYHANF-UHFFFAOYSA-N
Mol Weight 224.3 g/mol
Molecular Formula C16H16O
Exact Mass 224.120115 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 79CmyzEV3LR
Name 1,2-bis(3'-Methylphenyl)-etanone
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H16O
InChI InChI=1S/C16H16O/c1-12-5-3-7-14(9-12)11-16(17)15-8-4-6-13(2)10-15/h3-10H,11H2,1-2H3
InChIKey RKAQGCQFDYHANF-UHFFFAOYSA-N
Molecular Weight 224.303 g/mol
SMILES C(c1cc(C)ccc1)(Cc1cc(C)ccc1)=O
SPLASH splash10-014i-0900000000-31327a4ad880f9c9a605
Source of Spectrum MZ-34-4019-3
Synonyms 1,2-bis(3-methylphenyl)ethanone
Wiley ID 1582745