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(E)-1-(trans-3-methylcyclohexyl)-2-(4-tolyl)ethylene
SpectraBase Compound ID A9YkxigRIFn
InChI InChI=1S/C16H22/c1-13-6-8-15(9-7-13)10-11-16-5-3-4-14(2)12-16/h6-11,14,16H,3-5,12H2,1-2H3/b11-10+/t14-,16+/m1/s1
InChIKey XSCCNIGWRMTXIR-AGEWCLKBSA-N
Mol Weight 214.35 g/mol
Molecular Formula C16H22
Exact Mass 214.172151 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KyNQbAFUfjg
Name (E)-1-(trans-3-methylcyclohexyl)-2-(4-tolyl)ethylene
Comments Less than 3 mono-isotopic peaks
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Formula C16H22
InChI InChI=1S/C16H22/c1-13-6-8-15(9-7-13)10-11-16-5-3-4-14(2)12-16/h6-11,14,16H,3-5,12H2,1-2H3/b11-10+/t14-,16+/m1/s1
InChIKey XSCCNIGWRMTXIR-AGEWCLKBSA-N
Molecular Weight 214.352 g/mol
SMILES [C@]1(\C=C\c2ccc(cc2)C)(C[C@](C)(CCC1)[H])[H]
SPLASH splash10-014i-0900000000-a6dea5cd3e8856f9df17
Source of Spectrum KC-0-1729-28
Synonyms 1-methyl-4-{(E)-2-[(1R,3R)-3-methylcyclohexyl]ethenyl}benzene
Wiley ID 828453