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1H-1,2,4-Triazole-1-ethanol, 5-amino-.alpha.-methyl-3-nitro-
SpectraBase Compound ID CmRx5Nsbzxl
InChI InChI=1S/C5H9N5O3/c1-3(11)2-9-4(6)7-5(8-9)10(12)13/h3,11H,2H2,1H3,(H2,6,7,8)
InChIKey VFDFGKWTXPZWKM-UHFFFAOYSA-N
Mol Weight 187.16 g/mol
Molecular Formula C5H9N5O3
Exact Mass 187.070539 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FNyexSzDv6o
Name 1H-1,2,4-Triazole-1-ethanol, 5-amino-.alpha.-methyl-3-nitro-
Alternate Name(s) 1-(5-amino-3-nitro-1,2,4-triazol-1-yl)-2-propanol 1-(5-azanyl-3-nitro-1,2,4-triazol-1-yl)propan-2-ol
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C5H9N5O3
InChI InChI=1S/C5H9N5O3/c1-3(11)2-9-4(6)7-5(8-9)10(12)13/h3,11H,2H2,1H3,(H2,6,7,8)
InChIKey VFDFGKWTXPZWKM-UHFFFAOYSA-N
Molecular Weight 187.159 g/mol
SMILES Nc1nc(n[n]1CC(O)C)N(=O)=O
SPLASH splash10-0007-9100000000-4e2b22d96dc7b179b0f4
Source of Spectrum IY-1-4538-3
Wiley ID 1653366