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1-Phenyl-1-hexen-5-yn-3-ol
SpectraBase Compound ID AthdlX0H3UB
InChI InChI=1S/C12H12O/c1-2-6-12(13)10-9-11-7-4-3-5-8-11/h1,3-5,7-10,12-13H,6H2/b10-9+
InChIKey GFEXJIFQSYBITL-MDZDMXLPSA-N
Mol Weight 172.23 g/mol
Molecular Formula C12H12O
Exact Mass 172.088815 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IF3TjvOddLM
Name 1-Phenyl-1-hexen-5-yn-3-ol
Alternate Name(s) (E)-1-phenyl-3-hex-1-en-5-ynol (E)-1-phenylhex-1-en-5-yn-3-ol
Comments Less than 3 mono-isotopic peaks
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Formula C12H12O
InChI InChI=1S/C12H12O/c1-2-6-12(13)10-9-11-7-4-3-5-8-11/h1,3-5,7-10,12-13H,6H2/b10-9+
InChIKey GFEXJIFQSYBITL-MDZDMXLPSA-N
Molecular Weight 172.227 g/mol
SMILES OC(\C=C\c1ccccc1)CC#C
SPLASH splash10-00di-0900000000-58d91b2000c0185f3cf7
Source of Spectrum SK-29-1295-0
Wiley ID 880573