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2-(Benzylamino)-2-(thiophen-2-yl)acetonitrile
SpectraBase Compound ID 3yh7W8JKnMl
InChI InChI=1S/C13H12N2S/c14-9-12(13-7-4-8-16-13)15-10-11-5-2-1-3-6-11/h1-8,12,15H,10H2
InChIKey FFOXZSSIQUOPCL-UHFFFAOYSA-N
Mol Weight 228.31 g/mol
Molecular Formula C13H12N2S
Exact Mass 228.07212 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5KquOiiDsWM
Name 2-(Benzylamino)-2-(thiophen-2-yl)acetonitrile
Appearance Pale yellow oil
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 228.072119568 u
Formula C13H12N2S
InChI InChI=1S/C13H12N2S/c14-9-12(13-7-4-8-16-13)15-10-11-5-2-1-3-6-11/h1-8,12,15H,10H2
InChIKey FFOXZSSIQUOPCL-UHFFFAOYSA-N
Instrument Name Finnigan SSQ7000
Ionization Type EI
Literature Reference DOI 10.1002/chem.201603057
Molecular Weight 228.313 g/mol
Quality 148
SMILES N(CC1=CC=CC=C1)C(C#N)C=1SC=CC1
SPLASH splash10-0udl-5590000000-58b4a626e87d6e3de274
Source of Spectrum QE-22-SM6-6i (DOI: 10.1002/chem.201603057)
Wiley ID 1905157