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6-chloranyl-1-(2-ethynylphenyl)hex-1-yn-3-ol
SpectraBase Compound ID HRtn4Y4NLHh
InChI InChI=1S/C14H13ClO/c1-2-12-6-3-4-7-13(12)9-10-14(16)8-5-11-15/h1,3-4,6-7,14,16H,5,8,11H2
InChIKey AHDGEFYPNIBQCC-UHFFFAOYSA-N
Mol Weight 232.71 g/mol
Molecular Formula C14H13ClO
Exact Mass 232.065493 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 56u3EMl3P51
Name 6-chloranyl-1-(2-ethynylphenyl)hex-1-yn-3-ol
Comments Less than 3 mono-isotopic peaks
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Formula C14H13ClO
InChI InChI=1S/C14H13ClO/c1-2-12-6-3-4-7-13(12)9-10-14(16)8-5-11-15/h1,3-4,6-7,14,16H,5,8,11H2
InChIKey AHDGEFYPNIBQCC-UHFFFAOYSA-N
Molecular Weight 232.710 g/mol
SMILES OC(C#Cc1c(C#C)cccc1)CCCCl
SPLASH splash10-004i-0900000000-32338a008b6b42f95939
Source of Spectrum J-59-5043-24
Synonyms 6-chloro-1-(2-ethynylphenyl)-1-hexyn-3-ol 6-chloro-1-(2-ethynylphenyl)hex-1-yn-3-ol
Wiley ID 1233898