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N-(2,6-dimethylphenyl)-1-[2-(3-nitro-2-oxidanylidene-pyridin-1-yl)ethanoylamino]cyclohexane-1-carboxamide
SpectraBase Compound ID 8TPFadmr1N1
InChI InChI=1S/C22H26N4O5/c1-15-8-6-9-16(2)19(15)23-21(29)22(11-4-3-5-12-22)24-18(27)14-25-13-7-10-17(20(25)28)26(30)31/h6-10,13H,3-5,11-12,14H2,1-2H3,(H,23,29)(H,24,27)
InChIKey HJEFLOCIIYJQKB-UHFFFAOYSA-N
Mol Weight 426.47 g/mol
Molecular Formula C22H26N4O5
Exact Mass 426.19032 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AUTkQZzkV3X
Name N-(2,6-dimethylphenyl)-1-[2-(3-nitro-2-oxidanylidene-pyridin-1-yl)ethanoylamino]cyclohexane-1-carboxamide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H26N4O5
InChI InChI=1S/C22H26N4O5/c1-15-8-6-9-16(2)19(15)23-21(29)22(11-4-3-5-12-22)24-18(27)14-25-13-7-10-17(20(25)28)26(30)31/h6-10,13H,3-5,11-12,14H2,1-2H3,(H,23,29)(H,24,27)
InChIKey HJEFLOCIIYJQKB-UHFFFAOYSA-N
Molecular Weight 426.473 g/mol
SMILES N(C1(C(Nc2c(cccc2C)C)=O)CCCCC1)C(CN1C(C(N(=O)=O)=CC=C1)=O)=O
SPLASH splash10-0002-9400000000-0fcae5feb17446a10cbb
Synonyms N-(2,6-dimethylphenyl)-1-[[2-(2-keto-3-nitro-1-pyridyl)acetyl]amino]cyclohexanecarboxamide N-(2,6-dimethylphenyl)-1-[[2-(3-nitro-2-oxo-1-pyridinyl)-1-oxoethyl]amino]-1-cyclohexanecarboxamide N-(2,6-dimethylphenyl)-1-[[2-(3-nitro-2-oxo-1-pyridyl)acetyl]amino]cyclohexanecarboxamide N-(2,6-dimethylphenyl)-1-[[2-(3-nitro-2-oxopyridin-1-yl)acetyl]amino]cyclohexane-1-carboxamide
Wiley ID 1466290