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4-methylene-3-phenyl-1-cycloheptanone
SpectraBase Compound ID 9Ms4u6ooMX8
InChI InChI=1S/C14H16O/c1-11-6-5-9-13(15)10-14(11)12-7-3-2-4-8-12/h2-4,7-8,14H,1,5-6,9-10H2
InChIKey JHGLMLCZNNJDKC-UHFFFAOYSA-N
Mol Weight 200.28 g/mol
Molecular Formula C14H16O
Exact Mass 200.120115 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JrQWhh7ny6b
Name 4-methylene-3-phenyl-1-cycloheptanone
Alternate Name(s) 4-methylidene-3-phenyl-cycloheptan-1-one 4-methylidene-3-phenylcycloheptan-1-one
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H16O
InChI InChI=1S/C14H16O/c1-11-6-5-9-13(15)10-14(11)12-7-3-2-4-8-12/h2-4,7-8,14H,1,5-6,9-10H2
InChIKey JHGLMLCZNNJDKC-UHFFFAOYSA-N
Molecular Weight 200.281 g/mol
SMILES C1(CC(C(CCC1)=C)c1ccccc1)=O
SPLASH splash10-0ufr-5090000000-303a6f9a6c873614863e
Source of Spectrum F-70-6882-13
Wiley ID 1597386