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(R)-(-)-1-(2'-Methylphenyl)-4-(n-butyl)hexa-4,5-dien-1-yn-3-ol
SpectraBase Compound ID 6C3K2Y0S48u
InChI InChI=1S/C17H20O/c1-4-6-10-15(5-2)17(18)13-12-16-11-8-7-9-14(16)3/h7-9,11,17-18H,2,4,6,10H2,1,3H3/t17-/m1/s1
InChIKey PAVASEJDJPRUOV-QGZVFWFLSA-N
Mol Weight 240.35 g/mol
Molecular Formula C17H20O
Exact Mass 240.151415 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9GfIqBZq72u
Name (R)-(-)-1-(2'-Methylphenyl)-4-(n-butyl)hexa-4,5-dien-1-yn-3-ol
Comments Less than 3 mono-isotopic peaks
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Formula C17H20O
InChI InChI=1S/C17H20O/c1-4-6-10-15(5-2)17(18)13-12-16-11-8-7-9-14(16)3/h7-9,11,17-18H,2,4,6,10H2,1,3H3/t17-/m1/s1
InChIKey PAVASEJDJPRUOV-QGZVFWFLSA-N
Molecular Weight 240.346 g/mol
SMILES O[C@@](C(=C=C)CCCC)(C#Cc1c(C)cccc1)[H]
SPLASH splash10-0002-0900000000-cc213ba7d184e3c56819
Source of Spectrum KD-14-3664-3
Synonyms (3R)-4-butyl-1-(2-methylphenyl)-4,5-hexadien-1-yn-3-ol (3R)-4-ethenylidene-1-(2-methylphenyl)-1-octyn-3-ol (3R)-1-(o-tolyl)-4-vinylidene-oct-1-yn-3-ol (3R)-4-ethenylidene-1-(2-methylphenyl)oct-1-yn-3-ol
Wiley ID 1636479