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1-Methyl-4-nitro-imidazole
SpectraBase Compound ID CTWPAcCSKx6
InChI InChI=1S/C4H5N3O2/c1-6-2-4(5-3-6)7(8)9/h2-3H,1H3
InChIKey HSCOLDQJZRZQMV-UHFFFAOYSA-N
Mol Weight 127.1 g/mol
Molecular Formula C4H5N3O2
Exact Mass 127.038176 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5GJMze1Pvic
Name 1H-Imidazole, 1-methyl-4-nitro-
Alternate Name(s) 1-Methyl-4-nitro-1H-imidazole 1-Methyl-4-nitro-imidazole Imidazole, 1-methyl-4-nitro- AI3-51824 BRN 0123533
CAS Registry Number 3034-41-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C4H5N3O2
InChI InChI=1S/C4H5N3O2/c1-6-2-4(5-3-6)7(8)9/h2-3H,1H3
InChIKey HSCOLDQJZRZQMV-UHFFFAOYSA-N
Molecular Weight 127.103 g/mol
SMILES c1(N(=O)=O)nc[n](c1)C
SPLASH splash10-0f6x-9100000000-aa248cbf050ede961130
Source of Spectrum KO-8-355-2
Wiley ID 1130515