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4-Amino-3-ethynyl-benzonitrile
SpectraBase Compound ID A2Sg8AoCTNx
InChI InChI=1S/C9H6N2/c1-2-8-5-7(6-10)3-4-9(8)11/h1,3-5H,11H2
InChIKey GSBZUHOOEVXYCF-UHFFFAOYSA-N
Mol Weight 142.16 g/mol
Molecular Formula C9H6N2
Exact Mass 142.053098 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BN6XiIRFpJ2
Name 4-Amino-3-ethynyl-benzonitrile
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H6N2
InChI InChI=1S/C9H6N2/c1-2-8-5-7(6-10)3-4-9(8)11/h1,3-5H,11H2
InChIKey GSBZUHOOEVXYCF-UHFFFAOYSA-N
Molecular Weight 142.161 g/mol
SMILES Nc1c(cc(cc1)C#N)C#C
SPLASH splash10-0006-0900000000-188c0aadd7556e038568
Source of Spectrum U1-2001-4611-0
Synonyms 4-Azanyl-3-ethynyl-benzenecarbonitrile 4-Amino-3-ethynylbenzonitrile
Wiley ID 815210