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o-chlorohydrocinnamonitrile

View entire compound with spectra: 4 NMR, 4 FTIR, and 1 MS (GC)

o-chlorohydrocinnamonitrile
SpectraBase Compound ID FMyR7MVQ45O
InChI InChI=1S/C9H8ClN/c10-9-6-2-1-4-8(9)5-3-7-11/h1-2,4,6H,3,5H2
InChIKey MMTXIUJWFHJGBA-UHFFFAOYSA-N
Mol Weight 165.62 g/mol
Molecular Formula C9H8ClN
Exact Mass 165.034527 g/mol

13C Nuclear Magnetic Resonance (NMR) Spectrum

13C Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID FLXVd5iMNGF
Name 2-Chlorohydrocinnamonitrile
Source of Sample Sigma-Aldrich Co. LLC.
Catalog Number 346632
CAS Registry Number 7315-17-5
Copyright Copyright © 2021-2024 Sigma-Aldrich Co. LLC. - Database Compilation Copyright © 2021 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H8ClN
InChI InChI=1S/C9H8ClN/c10-9-6-2-1-4-8(9)5-3-7-11/h1-2,4,6H,3,5H2
InChIKey MMTXIUJWFHJGBA-UHFFFAOYSA-N
Observed nucleus 13C
Purity 99%
Solvent CDCl3
Source of Spectrum Sigma-Aldrich Co. LLC.
Synonyms 3-(2-Chlorophenyl)propionitrile
Wiley ID SIAL_13CNMR_007239