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2-Cyclohexylideneacetic acid methyl ester (D5)
SpectraBase Compound ID 6u8zCrozWRK
InChI InChI=1S/C9H14O2/c1-11-9(10)7-8-5-3-2-4-6-8/h7H,2-6H2,1H3
InChIKey SSYXINHPLNNOSJ-UHFFFAOYSA-N
Mol Weight 154.21 g/mol
Molecular Formula C9H14O2
Exact Mass 154.09938 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID B3j0VNJAj6O
Name 2-Cyclohexylideneacetic acid methyl ester (D5)
CAS Registry Number 10564-26-8
Comments Note: The molecular formula of the structure shown is C9H14O2 - which differs from the formula reported for the mass spectrum (C9H9D5O2)
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Formula C9H9D5O2
InChI InChI=1S/C9H14O2/c1-11-9(10)7-8-5-3-2-4-6-8/h7H,2-6H2,1H3
InChIKey SSYXINHPLNNOSJ-UHFFFAOYSA-N
Molecular Weight 154.209 g/mol
SMILES C1CCC(CC1)=CC(=O)OC
SPLASH splash10-0a6r-9700000000-3e768af163beb19f1702
Synonyms Methyl 2-cyclohexylideneacetate (D5) Methyl 2-cyclohexylideneethanoate (D5) Methyl cyclohexylideneacetate (D5)
Wiley ID 1488118