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2-Nitro-6-[(E)-(4H-1,2,4-triazol-4-ylimino)methyl]phenol
SpectraBase Compound ID KK2jFiNXJCY
InChI InChI=1S/C9H7N5O3/c15-9-7(2-1-3-8(9)14(16)17)4-12-13-5-10-11-6-13/h1-6,15H/b12-4+
InChIKey GLFABWHYADZKJE-UUILKARUSA-N
Mol Weight 233.19 g/mol
Molecular Formula C9H7N5O3
Exact Mass 233.054889 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FIKAgIbYUMz
Name 2-Nitro-6-[(E)-(4H-1,2,4-triazol-4-ylimino)methyl]phenol
Alternate Name(s) Phenol, 6-nitro-2-(1,2,4-triazol-4-yliminomethyl)-
CAS Registry Number 35546-56-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H7N5O3
InChI InChI=1S/C9H7N5O3/c15-9-7(2-1-3-8(9)14(16)17)4-12-13-5-10-11-6-13/h1-6,15H/b12-4+
InChIKey GLFABWHYADZKJE-UUILKARUSA-N
Molecular Weight 233.187 g/mol
SMILES Oc1c(N(=O)=O)cccc1\C=N\[n]1cnnc1
SPLASH splash10-11e9-9310000000-e3c7c54c4d632d261c3f
Source of Spectrum AD-0-2532-0
Wiley ID 1420317