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1,4-Di(cyclohepten-1-yl)butane-1,4-dione
SpectraBase Compound ID Lf1uUjFIwuJ
InChI InChI=1S/C18H26O2/c19-17(15-9-5-1-2-6-10-15)13-14-18(20)16-11-7-3-4-8-12-16/h9,11H,1-8,10,12-14H2
InChIKey ATAZUEBTQYKSHF-UHFFFAOYSA-N
Mol Weight 274.4 g/mol
Molecular Formula C18H26O2
Exact Mass 274.19328 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID A8ekaeZ2TRJ
Name 1,4-Di(cyclohepten-1-yl)butane-1,4-dione
Appearance Colorless solid
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Exact Mass 274.193280075 u
Formula C18H26O2
InChI InChI=1S/C18H26O2/c19-17(15-9-5-1-2-6-10-15)13-14-18(20)16-11-7-3-4-8-12-16/h9,11H,1-8,10,12-14H2
InChIKey ATAZUEBTQYKSHF-UHFFFAOYSA-N
Instrument Name Thermo Finnigan TSQ 700
Ionization Type EI
Literature Reference DOI 10.1002/chem.201804497
Molecular Weight 274.404 g/mol
Reported Formula C18H26O2
SMILES C(CC(C1=CCCCCC1)=O)C(C=1CCCCCC1)=O
SPLASH splash10-004i-1290000000-4bf69f369b12be3ed1cf
Source of Spectrum QE-24-SM8-S3 (DOI: 10.1002/chem.201804497)
Thin-Layer Chromatography 0.3 (n-pentane/ethyl acetate, 10:1)
Wiley ID 1901815