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2-(Benzylamino)-2-(4-chlorophenyl)acetonitrile
SpectraBase Compound ID I5ZLZraPwQb
InChI InChI=1S/C15H13ClN2/c16-14-8-6-13(7-9-14)15(10-17)18-11-12-4-2-1-3-5-12/h1-9,15,18H,11H2
InChIKey XIWURKWOFJMTPC-UHFFFAOYSA-N
Mol Weight 256.74 g/mol
Molecular Formula C15H13ClN2
Exact Mass 256.076726 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GIDGxdTmFFe
Name 2-(Benzylamino)-2-(4-chlorophenyl)acetonitrile
Appearance Pale yellow oil
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 256.076726127 u
Formula C15H13ClN2
InChI InChI=1S/C15H13ClN2/c16-14-8-6-13(7-9-14)15(10-17)18-11-12-4-2-1-3-5-12/h1-9,15,18H,11H2
InChIKey XIWURKWOFJMTPC-UHFFFAOYSA-N
Instrument Name Finnigan SSQ7000
Ionization Type EI
Literature Reference DOI 10.1002/chem.201603057
Molecular Weight 256.736 g/mol
Quality 253
SMILES N(CC1=CC=CC=C1)C(C#N)C1=CC=C(C=C1)Cl
SPLASH splash10-0006-9400000000-28a575895cf84697ab84
Source of Spectrum QE-22-SM5-6e (DOI: 10.1002/chem.201603057)
Thin-Layer Chromatography 0.28 (n-pentane/EtOAc, 20:1)
Wiley ID 1905153