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5-Chloranyl-2,2-dimethyl-pentanenitrile
SpectraBase Compound ID ALzS1uvQ0FE
InChI InChI=1S/C7H12ClN/c1-7(2,6-9)4-3-5-8/h3-5H2,1-2H3
InChIKey AGJFOWMZIAASOW-UHFFFAOYSA-N
Mol Weight 145.63 g/mol
Molecular Formula C7H12ClN
Exact Mass 145.065827 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 78m1InBMPs8
Name 5-Chloranyl-2,2-dimethyl-pentanenitrile
Alternate Name(s) 5-Chloro-2,2-dimethyl-pentanenitrile 5-Chloro-2,2-dimethyl-valeronitrile
CAS Registry Number 4207-54-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C7H12ClN
InChI InChI=1S/C7H12ClN/c1-7(2,6-9)4-3-5-8/h3-5H2,1-2H3
InChIKey AGJFOWMZIAASOW-UHFFFAOYSA-N
Molecular Weight 145.633 g/mol
SMILES CC(CCCCl)(C#N)C
SPLASH splash10-014i-9300000000-5dd879f535033b4a42d9
Source of Spectrum F-39-964-0
Wiley ID 1143355