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2-(5-Methyl-2-(2-(4-methylpiperazin-1-yl)ethoxy)benzyl)benzonitrile
SpectraBase Compound ID LCWgxPhuqBm
InChI InChI=1S/C22H27N3O/c1-18-7-8-22(26-14-13-25-11-9-24(2)10-12-25)21(15-18)16-19-5-3-4-6-20(19)17-23/h3-8,15H,9-14,16H2,1-2H3
InChIKey IPQVFXBACVQTGA-UHFFFAOYSA-N
Mol Weight 349.48 g/mol
Molecular Formula C22H27N3O
Exact Mass 349.215413 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2pbZahiLkJK
Name 2-(5-Methyl-2-(2-(4-methylpiperazin-1-yl)ethoxy)benzyl)benzonitrile
Appearance Brown viscous liquid
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Exact Mass 349.215412500 u
Formula C22H27N3O
InChI InChI=1S/C22H27N3O/c1-18-7-8-22(26-14-13-25-11-9-24(2)10-12-25)21(15-18)16-19-5-3-4-6-20(19)17-23/h3-8,15H,9-14,16H2,1-2H3
InChIKey IPQVFXBACVQTGA-UHFFFAOYSA-N
Instrument Name GCMS
Ionization Type EI
Molecular Weight 349.478 g/mol
Quality 137
SMILES CC=1C=CC(=C(C1)CC1=C(C=CC=C1)C#N)OCCN1CCN(CC1)C
SPLASH splash10-03fr-2900000000-6636488b62dcd984c64c
Source of Spectrum CN115243764A
Wiley ID 1894858