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Ethanone, 1-[5-methyl-3-(5-nitro-2-furanyl)-1H-1,2,4-triazol-1-yl]-
SpectraBase Compound ID BDateAffQKe
InChI InChI=1S/C9H8N4O4/c1-5-10-9(11-12(5)6(2)14)7-3-4-8(17-7)13(15)16/h3-4H,1-2H3
InChIKey MVJSGHMFEYLQLA-UHFFFAOYSA-N
Mol Weight 236.19 g/mol
Molecular Formula C9H8N4O4
Exact Mass 236.054555 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4hF6RdV2p8Z
Name Ethanone, 1-[5-methyl-3-(5-nitro-2-furanyl)-1H-1,2,4-triazol-1-yl]-
CAS Registry Number 35732-73-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H8N4O4
InChI InChI=1S/C9H8N4O4/c1-5-10-9(11-12(5)6(2)14)7-3-4-8(17-7)13(15)16/h3-4H,1-2H3
InChIKey MVJSGHMFEYLQLA-UHFFFAOYSA-N
Molecular Weight 236.187 g/mol
SMILES Cc1nc(-c2ccc(N(=O)=O)o2)n[n]1C(C)=O
SPLASH splash10-0006-8900000000-2e559e81d20da1834b45
Source of Spectrum AJ-45-1879-2
Synonyms 1-Acetyl-5-methyl-3-(5-nitro-2-furyl)-1H-1,2,4-triazole 1-[5-methyl-3-(5-nitro-2-furanyl)-1,2,4-triazol-1-yl]ethanone 1-[5-methyl-3-(5-nitro-2-furyl)-1,2,4-triazol-1-yl]ethanone 1-[5-methyl-3-(5-nitrofuran-2-yl)-1,2,4-triazol-1-yl]ethanone
Wiley ID 1237549