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3-ethynyl-1-cyclohex-2-enone
SpectraBase Compound ID JJ40KuGttae
InChI InChI=1S/C8H8O/c1-2-7-4-3-5-8(9)6-7/h1,6H,3-5H2
InChIKey HPMWHVMJEUBHPB-UHFFFAOYSA-N
Mol Weight 120.15 g/mol
Molecular Formula C8H8O
Exact Mass 120.057515 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID ADHEvm1QQu6
Name 3-ethynyl-1-cyclohex-2-enone
Alternate Name(s) 3-ethynyl-2-cyclohexen-1-one 3-ethynylcyclohex-2-en-1-one
Comments Less than 3 mono-isotopic peaks
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Formula C8H8O
InChI InChI=1S/C8H8O/c1-2-7-4-3-5-8(9)6-7/h1,6H,3-5H2
InChIKey HPMWHVMJEUBHPB-UHFFFAOYSA-N
Molecular Weight 120.151 g/mol
SMILES C1(C=C(CCC1)C#C)=O
SPLASH splash10-006x-9700000000-a97271bd301846585b40
Source of Spectrum KC-0-1023-15
Wiley ID 783660