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2-(1-Benzyl-1H-indol-3-yl)-2-methylpropanenitrile
SpectraBase Compound ID 4IYQa2iCic7
InChI InChI=1S/C19H18N2/c1-19(2,14-20)17-13-21(12-15-8-4-3-5-9-15)18-11-7-6-10-16(17)18/h3-11,13H,12H2,1-2H3
InChIKey WUIAPIRYUWPQKD-UHFFFAOYSA-N
Mol Weight 274.37 g/mol
Molecular Formula C19H18N2
Exact Mass 274.146999 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6rGzHATrB4d
Name 2-(1-Benzyl-1H-indol-3-yl)-2-methylpropanenitrile
Appearance White solid
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Formula C19H18N2
InChI InChI=1S/C19H18N2/c1-19(2,14-20)17-13-21(12-15-8-4-3-5-9-15)18-11-7-6-10-16(17)18/h3-11,13H,12H2,1-2H3
InChIKey WUIAPIRYUWPQKD-UHFFFAOYSA-N
Instrument Name SHIMADZU GCMS-QP2010
Ionization Type EI
Literature Reference DOI 10.1021/acs.joc.1c00808
Molecular Weight 274.367 g/mol
Reported Formula C19H18N2
SMILES c1(ccccc1)C[n]1cc(c2c1cccc2)C(C#N)(C)C
SPLASH splash10-0006-9030000000-54dfb7e4b342a3d7ed7d
Source of Spectrum JOC-86-8395-3oa
Wiley ID 1867826