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1-[4-(3-amino-1H-1,2,4-triazol-5-yl)butyl]-3-cyano-2-methyl-guanidine
SpectraBase Compound ID CA5Zmu0tBct
InChI InChI=1S/C9H16N8/c1-12-9(14-6-10)13-5-3-2-4-7-15-8(11)17-16-7/h2-5H2,1H3,(H2,12,13,14)(H3,11,15,16,17)
InChIKey ZSDXPCUFDUAKJY-UHFFFAOYSA-N
Mol Weight 236.28 g/mol
Molecular Formula C9H16N8
Exact Mass 236.149793 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID d8iEpVE9Y
Name 1-[4-(3-amino-1H-1,2,4-triazol-5-yl)butyl]-3-cyano-2-methyl-guanidine
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H16N8
InChI InChI=1S/C9H16N8/c1-12-9(14-6-10)13-5-3-2-4-7-15-8(11)17-16-7/h2-5H2,1H3,(H2,12,13,14)(H3,11,15,16,17)
InChIKey ZSDXPCUFDUAKJY-UHFFFAOYSA-N
Molecular Weight 236.283 g/mol
SMILES [nH]1nc(nc1N)CCCCN\C(=N/C#N)NC
SPLASH splash10-052g-9300000000-ce18e46e893a2c7603b5
Synonyms 1-[4-(3-azanyl-1H-1,2,4-triazol-5-yl)butyl]-3-cyano-2-methyl-guanidine Guanidine, N-[4-(5-amino-1H-1,2,4-triazol-3-yl)butyl]-N''-cyano-N'-methyl-
Wiley ID 1448287