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4-Amino-3-chloro-benzonitrile
SpectraBase Compound ID JDNMqcqlGgn
InChI InChI=1S/C7H5ClN2/c8-6-3-5(4-9)1-2-7(6)10/h1-3H,10H2
InChIKey OREVCMGFYSUYPX-UHFFFAOYSA-N
Mol Weight 152.58 g/mol
Molecular Formula C7H5ClN2
Exact Mass 152.014126 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2BfpCJ4xjpa
Name 4-Amino-3-chloro-benzonitrile
CAS Registry Number 21803-75-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C7H5ClN2
InChI InChI=1S/C7H5ClN2/c8-6-3-5(4-9)1-2-7(6)10/h1-3H,10H2
InChIKey OREVCMGFYSUYPX-UHFFFAOYSA-N
Literature Reference DOI 10.1021/ol7025872
Molecular Weight 152.584 g/mol
SMILES Nc1ccc(cc1Cl)C#N
SPLASH splash10-0udi-0900000000-e32ae18805054b547f40
Source of Spectrum A1-10-113/SM36-arb3
Synonyms 4-Amino-3-chlorobenzonitrile 4-Azanyl-3-chloranyl-benzenecarbonitrile
Wiley ID 1758943