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(4-Chloro-phenyl)-acetonitrile
SpectraBase Compound ID 1wttDlvfHBm
InChI InChI=1S/C8H6ClN/c9-8-3-1-7(2-4-8)5-6-10/h1-4H,5H2
InChIKey IVYMIRMKXZAHRV-UHFFFAOYSA-N
Mol Weight 151.6 g/mol
Molecular Formula C8H6ClN
Exact Mass 151.018877 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8Ho9CgpgoXQ
Name (4-Chlorophenyl)acetonitrile
CAS Registry Number 140-53-4
Classification Chemical
Copyright Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 151.018876897 u
Formula C8H6ClN
InChI InChI=1S/C8H6ClN/c9-8-3-1-7(2-4-8)5-6-10/h1-4H,5H2
InChIKey IVYMIRMKXZAHRV-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 151.596 g/mol
Nominal Mass 151 u
Quality 939
Retention Index 1091
SMILES C=1(C=CC(=CC1)Cl)CC#N
SPLASH splash10-0gb9-5900000000-07bf8a8f7e738901c48c
Source of Spectrum DigiLab GmbH (C) 2024
Synonyms 4-Chlorobenzyl cyanide
Technique GC/MS
Wiley ID DD2024_018771