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2-Butanone, 1-bicyclo[4.1.0]hept-2-en-2-yl-3,3-dimethyl-
SpectraBase Compound ID KB3DQIHJNkX
InChI InChI=1S/C13H20O/c1-13(2,3)12(14)8-10-6-4-5-9-7-11(9)10/h6,9,11H,4-5,7-8H2,1-3H3
InChIKey OHDCGTNLWJWDIS-UHFFFAOYSA-N
Mol Weight 192.3 g/mol
Molecular Formula C13H20O
Exact Mass 192.151415 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CcjJOa689UP
Name 2-Butanone, 1-bicyclo[4.1.0]hept-2-en-2-yl-3,3-dimethyl-
Alternate Name(s) 1-Bicyclo[4.1.0]hept-2-en-2-yl-3,3-dimethyl-2-butanone
CAS Registry Number 59671-50-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H20O
InChI InChI=1S/C13H20O/c1-13(2,3)12(14)8-10-6-4-5-9-7-11(9)10/h6,9,11H,4-5,7-8H2,1-3H3
InChIKey OHDCGTNLWJWDIS-UHFFFAOYSA-N
Molecular Weight 192.302 g/mol
SMILES C12CC2CCC=C1CC(C(C)(C)C)=O
SPLASH splash10-0a4i-9000000000-da5124137a23f200ed79
Source of Spectrum J-41-3081-0
Wiley ID 1189170