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Hexanenitrile, 5-methyl-
SpectraBase Compound ID DwWtaf5hGiB
InChI InChI=1S/C7H13N/c1-7(2)5-3-4-6-8/h7H,3-5H2,1-2H3
InChIKey CHWIKAJVZUSSML-UHFFFAOYSA-N
Mol Weight 111.19 g/mol
Molecular Formula C7H13N
Exact Mass 111.104799 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GBe4rHuWc9M
Name Hexanenitrile, 5-methyl-
CAS Registry Number 19424-34-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C7H13N
InChI InChI=1S/C7H13N/c1-7(2)5-3-4-6-8/h7H,3-5H2,1-2H3
InChIKey CHWIKAJVZUSSML-UHFFFAOYSA-N
Molecular Weight 111.188 g/mol
SMILES C(CCC#N)C(C)C
SPLASH splash10-0006-9000000000-731ae0b14ee36c58245f
Source of Spectrum C-86-1387-1
Synonyms 5-Methylhexanenitrile
Wiley ID 1122878