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Ethyl 5-(1'-cyclohexenyl)-2-methyl-2-penten-ynoate
SpectraBase Compound ID 3vAVghgnkkA
InChI InChI=1S/C14H18O2/c1-3-16-14(15)12(2)8-7-11-13-9-5-4-6-10-13/h8-9H,3-6,10H2,1-2H3/b12-8+
InChIKey VEBYJCIXQBOPCN-XYOKQWHBSA-N
Mol Weight 218.3 g/mol
Molecular Formula C14H18O2
Exact Mass 218.13068 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6YVeYt0lKEK
Name Ethyl 5-(1'-cyclohexenyl)-2-methyl-2-penten-ynoate
Alternate Name(s) ethyl (2E)-5-(1-cyclohexen-1-yl)-2-methyl-2-penten-4-ynoate
Comments Less than 3 mono-isotopic peaks
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Formula C14H18O2
InChI InChI=1S/C14H18O2/c1-3-16-14(15)12(2)8-7-11-13-9-5-4-6-10-13/h8-9H,3-6,10H2,1-2H3/b12-8+
InChIKey VEBYJCIXQBOPCN-XYOKQWHBSA-N
Molecular Weight 218.296 g/mol
SMILES C(\C(=C\C#CC1=CCCCC1)C)(=O)OCC
SPLASH splash10-014i-0490000000-c866d44b5ca0dd98a1a5
Source of Spectrum U-1996-1493-3
Wiley ID 768931