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trans-3-Methylbuta-1,2-dienyl-2-prop-2-ynylcyclopentanol
SpectraBase Compound ID 2n3Dg3Z0uQr
InChI InChI=1S/C13H18O/c1-4-6-12-7-5-9-13(12,14)10-8-11(2)3/h1,10,12,14H,5-7,9H2,2-3H3/t12-,13-/m0/s1
InChIKey QSLWDCIDQCCBKZ-STQMWFEESA-N
Mol Weight 190.29 g/mol
Molecular Formula C13H18O
Exact Mass 190.135765 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EL8Euejep8C
Name trans-3-Methylbuta-1,2-dienyl-2-prop-2-ynylcyclopentanol
Appearance Pale yellow oil
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Exact Mass 190.135765199 u
Formula C13H18O
InChI InChI=1S/C13H18O/c1-4-6-12-7-5-9-13(12,14)10-8-11(2)3/h1,10,12,14H,5-7,9H2,2-3H3/t12-,13-/m0/s1
InChIKey QSLWDCIDQCCBKZ-STQMWFEESA-N
Instrument Name Agilent Technologies 7890A-5975C
Ionization Type EI
Literature Reference DOI 10.1002/chem.201404487
Molecular Weight 190.286 g/mol
Quality 383
Reported Formula C13H18O
SMILES O[C@@]1(CCC[C@@]1(CC#C)[H])C=C=C(C)C
SPLASH splash10-066r-9300000000-963206cc97d45d0d91aa
Source of Spectrum QE-21-SM9-S4f (DOI: 10.1002/chem.201404487)
Thin-Layer Chromatography 0.51 (PE/EtOAc, 80:20)
Wiley ID 1906825