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Ethanol, 1-[(2,4-dinitrophenyl)amino]-1-isocyano-
SpectraBase Compound ID L69m3C0yJMu
InChI InChI=1S/C9H8N4O5/c1-9(14,10-2)11-7-4-3-6(12(15)16)5-8(7)13(17)18/h3-5,11,14H,1H3
InChIKey KXYIWPWIPDXTEX-UHFFFAOYSA-N
Mol Weight 252.19 g/mol
Molecular Formula C9H8N4O5
Exact Mass 252.049469 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9uE1pNUGU5n
Name Ethanol, 1-[(2,4-dinitrophenyl)amino]-1-isocyano-
Alternate Name(s) N(1isocyano-1-hydroxyethane)2,4-dinitro aniline N-(1-hydroxy-1-isocyanoethyl)-2,4-dinitroaniline 1-(2,4-dinitroanilino)-1-isocyanoethanol 1-[(2,4-dinitrophenyl)amino]-1-isocyano-ethanol
CAS Registry Number 56667-05-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H8N4O5
InChI InChI=1S/C9H8N4O5/c1-9(14,10-2)11-7-4-3-6(12(15)16)5-8(7)13(17)18/h3-5,11,14H,1H3
InChIKey KXYIWPWIPDXTEX-UHFFFAOYSA-N
Molecular Weight 252.186 g/mol
SMILES N(C([N+]#[C-])(O)C)c1c(N(=O)=O)cc(N(=O)=O)cc1
SPLASH splash10-03di-9730000000-dcfb166f966169f5145d
Source of Spectrum EP-5744-0-0
Wiley ID 1254959