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1,2-Bis(3-oxobutyl)benzene
SpectraBase Compound ID HrrG9mNsvao
InChI InChI=1S/C14H18O2/c1-11(15)7-9-13-5-3-4-6-14(13)10-8-12(2)16/h3-6H,7-10H2,1-2H3
InChIKey NZCBCBSSQIMHHK-UHFFFAOYSA-N
Mol Weight 218.3 g/mol
Molecular Formula C14H18O2
Exact Mass 218.13068 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DyfHBRfyH7w
Name 1,2-Bis(3-oxobutyl)benzene
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H18O2
InChI InChI=1S/C14H18O2/c1-11(15)7-9-13-5-3-4-6-14(13)10-8-12(2)16/h3-6H,7-10H2,1-2H3
InChIKey NZCBCBSSQIMHHK-UHFFFAOYSA-N
Literature Reference DOI 10.1002_(SICI)1521-3897(199902)341_2_138
Molecular Weight 218.296 g/mol
SMILES c1cc(c(CCC(=O)C)cc1)CCC(C)=O
SPLASH splash10-00kg-3900000000-3d040d71ec080905b91b
Source of Spectrum JF-341-141-16
Synonyms 4,4'-(1,2-phenylene)bis(butan-2-one) 4-[2-(3-oxobutyl)phenyl]-2-butanone 4-[2-(3-oxobutyl)phenyl]butan-2-one 4-[2-(3-oxidanylidenebutyl)phenyl]butan-2-one
Wiley ID 1766659