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2-Buten-1-one, 1-bicyclo[4.1.0]hept-7-yl-3-methyl-
SpectraBase Compound ID CXeWQMpOyM3
InChI InChI=1S/C12H18O/c1-8(2)7-11(13)12-9-5-3-4-6-10(9)12/h7,9-10,12H,3-6H2,1-2H3
InChIKey UEBBSWFYKNVYHA-UHFFFAOYSA-N
Mol Weight 178.27 g/mol
Molecular Formula C12H18O
Exact Mass 178.135765 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5EDsqASJTki
Name 2-Buten-1-one, 1-bicyclo[4.1.0]hept-7-yl-3-methyl-
Alternate Name(s) 1-bicyclo[4.1.0]hept-7-yl-3-methyl-2-buten-1-one 7-(2-Methyl-1-propenyl)carbonyl)bicyclo[4.1.0]heptane
CAS Registry Number 108163-55-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H18O
InChI InChI=1S/C12H18O/c1-8(2)7-11(13)12-9-5-3-4-6-10(9)12/h7,9-10,12H,3-6H2,1-2H3
InChIKey UEBBSWFYKNVYHA-UHFFFAOYSA-N
Molecular Weight 178.275 g/mol
SMILES C1(C2CCCCC12)C(C=C(C)C)=O
SPLASH splash10-0a5i-7900000000-b938361c8ba421a1127f
Source of Spectrum AJ-59-2859-20
Wiley ID 1174772