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((((1S,2R,5S)-2-isopropyl-5-methylcyclohexyl)oxy)methyl)benzene
SpectraBase Compound ID 5TazZUWiYlX
InChI InChI=1S/C17H26O/c1-13(2)16-10-9-14(3)11-17(16)18-12-15-7-5-4-6-8-15/h4-8,13-14,16-17H,9-12H2,1-3H3/t14-,16+,17-/m0/s1
InChIKey BXDYPFZPBRBYLA-UAGQMJEPSA-N
Mol Weight 246.39 g/mol
Molecular Formula C17H26O
Exact Mass 246.198365 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BEPaBJi2GAL
Name ((((1S,2R,5S)-2-isopropyl-5-methylcyclohexyl)oxy)methyl)benzene
Appearance Colorless oil
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Exact Mass 246.198365456 u
Formula C17H26O
InChI InChI=1S/C17H26O/c1-13(2)16-10-9-14(3)11-17(16)18-12-15-7-5-4-6-8-15/h4-8,13-14,16-17H,9-12H2,1-3H3/t14-,16+,17-/m0/s1
InChIKey BXDYPFZPBRBYLA-UAGQMJEPSA-N
Instrument Name Thermo ELECTRON CORPORATION MAT 95XP
Ionization Type EI
Literature Reference DOI 10.1002/chem.202103903
Molecular Weight 246.394 g/mol
Quality 195
SMILES C(C)(C)[C@@]1([C@](C[C@](CC1)(C)[H])(OCC1=CC=CC=C1)[H])[H]
SPLASH splash10-0006-9300000000-efe26ebd4252245becab
Source of Spectrum QE-28-SM21-3am (DOI: 10.1002/chem.202103903)
Thin-Layer Chromatography 0.57 (Pentane/ethyl acetate, 95:5)
Wiley ID 1898287