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trans-3-Methylpenta-1,2-dienyl-2-prop-2-ynylcyclohexanol
SpectraBase Compound ID DjlUTa6Lw2y
InChI InChI=1S/C15H22O/c1-4-8-14-9-6-7-11-15(14,16)12-10-13(3)5-2/h1,12,14,16H,5-9,11H2,2-3H3/t10?,14-,15-/m0/s1
InChIKey VNSZPCVMSMJGLO-YSYSQYOCSA-N
Mol Weight 218.34 g/mol
Molecular Formula C15H22O
Exact Mass 218.167065 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID B9k1nsuHAOT
Name trans-3-Methylpenta-1,2-dienyl-2-prop-2-ynylcyclohexanol
Appearance Pale yellow oil
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Exact Mass 218.167065327 u
Formula C15H22O
InChI InChI=1S/C15H22O/c1-4-8-14-9-6-7-11-15(14,16)12-10-13(3)5-2/h1,12,14,16H,5-9,11H2,2-3H3/t10?,14-,15-/m0/s1
InChIKey VNSZPCVMSMJGLO-YSYSQYOCSA-N
Instrument Name Agilent Technologies 7890A-5975C
Ionization Type EI
Literature Reference DOI 10.1002/chem.201404487
Molecular Weight 218.340 g/mol
Quality 301
Reported Formula C15H22O
SMILES O[C@@]1(CCCC[C@@]1(CC#C)[H])C(=[C@]=C(CC)C)[H]
SPLASH splash10-0699-9700000000-eccc3d906c433ddf6d63
Sample Comments dr = 1:1
Source of Spectrum QE-21-SM7-S4b (DOI: 10.1002/chem.201404487)
Thin-Layer Chromatography 0.57 (PE/EtOAc, 80:20)
Wiley ID 1906821