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2,3,5-Trichloro-6-[1,4]diazepan-1-yl-isonicotinonitrile
SpectraBase Compound ID KtmjBgeXaGs
InChI InChI=1S/C11H11Cl3N4/c12-8-7(6-15)9(13)11(17-10(8)14)18-4-1-2-16-3-5-18/h16H,1-5H2
InChIKey HOPCRPJOSCCCFJ-UHFFFAOYSA-N
Mol Weight 305.6 g/mol
Molecular Formula C11H11Cl3N4
Exact Mass 304.004929 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8c7qDxvfbCo
Name 2,3,5-Trichloro-6-[1,4]diazepan-1-yl-isonicotinonitrile
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H11Cl3N4
InChI InChI=1S/C11H11Cl3N4/c12-8-7(6-15)9(13)11(17-10(8)14)18-4-1-2-16-3-5-18/h16H,1-5H2
InChIKey HOPCRPJOSCCCFJ-UHFFFAOYSA-N
Molecular Weight 305.596 g/mol
SMILES N1CCCN(CC1)c1nc(c(c(C#N)c1Cl)Cl)Cl
SPLASH splash10-0006-9010000000-b725b9b1a07ae6ec3177
Synonyms 2,3,5-trichloro-6-(1,4-diazepan-1-yl)-4-pyridinecarbonitrile 2,3,5-trichloro-6-(1,4-diazepan-1-yl)pyridine-4-carbonitrile 2,3,5-tris(chloranyl)-6-(1,4-diazepan-1-yl)pyridine-4-carbonitrile
Wiley ID 1459491