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(1E)-1-(3,3-dimethyl-2-bicyclo[2.2.1]heptanylidene)-2-propanone
SpectraBase Compound ID CXkuDXnFopv
InChI InChI=1S/C12H18O/c1-8(13)6-11-9-4-5-10(7-9)12(11,2)3/h6,9-10H,4-5,7H2,1-3H3/b11-6+
InChIKey XALOCGICVJIHMO-IZZDOVSWSA-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 6KnwFT2QAJ1
Name (1E)-1-(3,3-dimethyl-2-bicyclo[2.2.1]heptanylidene)-2-propanone
Alternate Name(s) (1E)-1-(3,3-dimethyl-2-bicyclo[2.2.1]heptanylidene)propan-2-one (1E)-1-(3,3-dimethylnorbornan-2-ylidene)acetone (1E)-1-(3,3-dimethylnorbornan-2-ylidene)propan-2-one
CAS Registry Number 69926-90-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H18O
InChI InChI=1S/C12H18O/c1-8(13)6-11-9-4-5-10(7-9)12(11,2)3/h6,9-10H,4-5,7H2,1-3H3/b11-6+
InChIKey XALOCGICVJIHMO-IZZDOVSWSA-N
Molecular Weight 178.275 g/mol
SMILES C1(\C(C2CC1CC2)=C\C(=O)C)(C)C
SPLASH splash10-004i-0900000000-f5729a0b23b1671019fb
Source of Spectrum K-112-418-0
Wiley ID 1174637