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5-(p-Cyanobenzyl)bicyclo[4.1.0]heptan-2-one
SpectraBase Compound ID GN1gK2EKUKn
InChI InChI=1S/C15H15NO/c16-9-11-3-1-10(2-4-11)7-12-5-6-15(17)14-8-13(12)14/h1-4,12-14H,5-8H2
InChIKey YMDMOWOHWQQRAC-UHFFFAOYSA-N
Mol Weight 225.29 g/mol
Molecular Formula C15H15NO
Exact Mass 225.115364 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID C0GYgQaBjAC
Name 5-(p-Cyanobenzyl)bicyclo[4.1.0]heptan-2-one
Alternate Name(s) 4-[(5-oxobicyclo[4.1.0]hept-2-yl)methyl]benzonitrile
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H15NO
InChI InChI=1S/C15H15NO/c16-9-11-3-1-10(2-4-11)7-12-5-6-15(17)14-8-13(12)14/h1-4,12-14H,5-8H2
InChIKey YMDMOWOHWQQRAC-UHFFFAOYSA-N
Molecular Weight 225.291 g/mol
SMILES C12C(C(=O)CCC2Cc2ccc(C#N)cc2)C1
SPLASH splash10-053r-9710000000-ca47bbe25e5709e3232d
Source of Spectrum F-54-6440-27
Wiley ID 807443