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(E)-1-Phenyl-1-tetrahydrofuranylhepta-1-en-3,5-diyne
SpectraBase Compound ID DcgAlra3w3j
InChI InChI=1S/C17H16O/c1-2-3-4-8-12-16(17-13-9-14-18-17)15-10-6-5-7-11-15/h5-7,10-12,17H,9,13-14H2,1H3/b16-12+
InChIKey PHXLPKZRWPITII-FOWTUZBSSA-N
Mol Weight 236.31 g/mol
Molecular Formula C17H16O
Exact Mass 236.120115 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 62A41wjVwxc
Name (E)-1-Phenyl-1-tetrahydrofuranylhepta-1-en-3,5-diyne
Alternate Name(s) 2-((E)-1-Phenyl-hept-1-ene-3,5-diynyl)-tetrahydro-furan 2-[(1E)-1-phenyl-1-heptene-3,5-diynyl]tetrahydrofuran
Comments Less than 3 mono-isotopic peaks
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Formula C17H16O
InChI InChI=1S/C17H16O/c1-2-3-4-8-12-16(17-13-9-14-18-17)15-10-6-5-7-11-15/h5-7,10-12,17H,9,13-14H2,1H3/b16-12+
InChIKey PHXLPKZRWPITII-FOWTUZBSSA-N
Molecular Weight 236.314 g/mol
SMILES C(\C=C\(C1OCCC1)c1ccccc1)#CC#CC
SPLASH splash10-000i-0090000000-8fa57a1d11d42b609315
Source of Spectrum QB-13-657-5
Wiley ID 841095