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1H-Pyrrole-3-carbonitrile, 2-amino-1-[(4-chlorophenyl)methyl]-4,5-dimethyl-
SpectraBase Compound ID GDJ0TXLuQsi
InChI InChI=1S/C14H14ClN3/c1-9-10(2)18(14(17)13(9)7-16)8-11-3-5-12(15)6-4-11/h3-6H,8,17H2,1-2H3
InChIKey OUMXANFMFANTQF-UHFFFAOYSA-N
Mol Weight 259.74 g/mol
Molecular Formula C14H14ClN3
Exact Mass 259.087625 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4Shn0FJThO5
Name 1H-Pyrrole-3-carbonitrile, 2-amino-1-[(4-chlorophenyl)methyl]-4,5-dimethyl-
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H14ClN3
InChI InChI=1S/C14H14ClN3/c1-9-10(2)18(14(17)13(9)7-16)8-11-3-5-12(15)6-4-11/h3-6H,8,17H2,1-2H3
InChIKey OUMXANFMFANTQF-UHFFFAOYSA-N
Molecular Weight 259.740 g/mol
SMILES Nc1[n](c(c(c1C#N)C)C)Cc1ccc(cc1)Cl
SPLASH splash10-003r-2930000000-d0f18e871ebe1115f8b3
Source of Spectrum IY-1-4381-7
Synonyms 2-Amino-1-[(4-chlorophenyl)methyl]-4,5-dimethyl-3-pyrrolecarbonitrile 2-Amino-1-[(4-chlorophenyl)methyl]-4,5-dimethylpyrrole-3-carbonitrile 2-Amino-1-[(4-chlorophenyl)methyl]-4,5-dimethyl-pyrrole-3-carbonitrile 2-Azanyl-1-[(4-chlorophenyl)methyl]-4,5-dimethyl-pyrrole-3-carbonitrile
Wiley ID 1651800