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3-(but-1-enyl)-2,4,4-trimethylcyclohexan-1-ol
SpectraBase Compound ID 9fRkph0XdQ5
InChI InChI=1S/C13H24O/c1-5-6-7-11-10(2)12(14)8-9-13(11,3)4/h6-7,10-12,14H,5,8-9H2,1-4H3
InChIKey ORUJVSLPJOWGCM-UHFFFAOYSA-N
Mol Weight 196.33 g/mol
Molecular Formula C13H24O
Exact Mass 196.182715 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7FplHoFoAcq
Name 3-(but-1-enyl)-2,4,4-trimethylcyclohexan-1-ol
Carrier Gas Helium (75 kPa) (2.5 ml/min)
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Exact Mass 196.182715392 u
Formula C13H24O
GC Column DB-Wax or DB-1 or DB-210 (30 m x 0.32 mm, film thickness 0.25 micrometer)
GC Oven Program Oven temp 200oC
InChI InChI=1S/C13H24O/c1-5-6-7-11-10(2)12(14)8-9-13(11,3)4/h6-7,10-12,14H,5,8-9H2,1-4H3
InChIKey ORUJVSLPJOWGCM-UHFFFAOYSA-N
Inlet Type Split (1:24)
Instrument Name Shimadzu GC 14A
Ionization Type EI
Literature Reference DOI 10.1002/jhrc.1240141118
Molecular Weight 196.334 g/mol
Quality 167
SMILES OC1C(C(C=CCC)C(CC1)(C)C)C
SPLASH splash10-0006-9300000000-a89a71f4d5d0cf9d886f
Source of Spectrum HRC-14-774-32 (DOI: 10.1002/jhrc.1240141118)
Wiley ID 1910735