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bis(p-Chlorophenyl)acetonitrile
SpectraBase Compound ID AxTurCwrUUt
InChI InChI=1S/C14H9Cl2N/c15-12-5-1-10(2-6-12)14(9-17)11-3-7-13(16)8-4-11/h1-8,14H
InChIKey FOWHYJUXPOOLJN-UHFFFAOYSA-N
Mol Weight 262.14 g/mol
Molecular Formula C14H9Cl2N
Exact Mass 261.011205 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID LDz8ubMGbMt
Name bis(p-Chlorophenyl)acetonitrile
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 261.011204694 u
Formula C14H9Cl2N
InChI InChI=1S/C14H9Cl2N/c15-12-5-1-10(2-6-12)14(9-17)11-3-7-13(16)8-4-11/h1-8,14H
InChIKey FOWHYJUXPOOLJN-UHFFFAOYSA-N
Molecular Weight 262.139 g/mol
SMILES C=1C(=CC=C(C1)Cl)C(C=1C=CC(=CC1)Cl)C#N