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4-Chloro-2-fluorophenylacetonitrile
SpectraBase Compound ID KGfCoWDsKU7
InChI InChI=1S/C8H5ClFN/c9-7-2-1-6(3-4-11)8(10)5-7/h1-2,5H,3H2
InChIKey RTQOANCZEAIDEZ-UHFFFAOYSA-N
Mol Weight 169.59 g/mol
Molecular Formula C8H5ClFN
Exact Mass 169.009455 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2oy2wJiTH3A
Name 4-Chloro-2-fluorobenzyl cyanide
CAS Registry Number 75279-55-9
Classification Designer drug precursor
Copyright Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 169.009455028 u
Formula C8H5ClFN
InChI InChI=1S/C8H5ClFN/c9-7-2-1-6(3-4-11)8(10)5-7/h1-2,5H,3H2
InChIKey RTQOANCZEAIDEZ-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 169.586 g/mol
Nominal Mass 169 u
Quality 901
Retention Index 1226
SMILES C=1(C(=CC(=CC1)Cl)F)CC#N
SPLASH splash10-001i-3900000000-aba31af59a997c9cfb7c
Source of Spectrum DigiLab GmbH (C) 2024
Synonyms (4-chloro-2-fluorophenyl)acetonitrile
Technique GC/MS
Wiley ID DD2024_004844