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5-[(5-Amino-4H-1,2,4-triazol-3-yl)methyl]-1H-1,2,4-triazol-3-amine
SpectraBase Compound ID AP2ztvXyVR5
InChI InChI=1S/C5H8N8/c6-4-8-2(10-12-4)1-3-9-5(7)13-11-3/h1H2,(H3,6,8,10,12)(H3,7,9,11,13)
InChIKey MBNDVRNZPXEYHL-UHFFFAOYSA-N
Mol Weight 180.18 g/mol
Molecular Formula C5H8N8
Exact Mass 180.087192 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8nm7Kdur1Gr
Name 5-[(5-Amino-4H-1,2,4-triazol-3-yl)methyl]-1H-1,2,4-triazol-3-amine
Alternate Name(s) 1H-1,2,4-Triazol-3-amine, 5,5'-methylenebis- 5-[(3-amino-1H-1,2,4-triazol-5-yl)methyl]-1H-1,2,4-triazol-3-amine 5-[(3-azanyl-1H-1,2,4-triazol-5-yl)methyl]-1H-1,2,4-triazol-3-amine S-Triazole, 3,3'-methylenebis[5-amino- [5-[(3-amino-1H-1,2,4-triazol-5-yl)methyl]-1H-1,2,4-triazol-3-yl]amine
CAS Registry Number 22819-11-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C5H8N8
InChI InChI=1S/C5H8N8/c6-4-8-2(10-12-4)1-3-9-5(7)13-11-3/h1H2,(H3,6,8,10,12)(H3,7,9,11,13)
InChIKey MBNDVRNZPXEYHL-UHFFFAOYSA-N
Molecular Weight 180.175 g/mol
SMILES [nH]1c(N)nnc1Cc1nc(n[nH]1)N
SPLASH splash10-0006-9100000000-54fba5b6c2c51051254a
Source of Spectrum AD-0-2532-0
Wiley ID 1427042