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3-(3,5-Dimethyl-1H-pyrazol-1-yl)-3-oxo-2-[2-{4-((1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)-diazenyl)-3-methyl-1H-pyrazol-5-yl}hydrazono]-propanenitrile
SpectraBase Compound ID LjO2ShicK29
InChI InChI=1S/C23H23N11O2/c1-13-11-14(2)33(31-13)22(35)18(12-24)26-30-21-19(15(3)25-29-21)27-28-20-16(4)32(5)34(23(20)36)17-9-7-6-8-10-17/h6-11H,1-5H3,(H2,25,29,30)/b26-18+,28-27+
InChIKey HJSCLYGCCLHVKQ-ARLIEJOZSA-N
Mol Weight 485.51 g/mol
Molecular Formula C23H23N11O2
Exact Mass 485.203619 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID J07G3HO5ZAU
Name 3-(3,5-Dimethyl-1H-pyrazol-1-yl)-3-oxo-2-[2-{4-((1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)-diazenyl)-3-methyl-1H-pyrazol-5-yl}hydrazono]-propanenitrile
Alternate Name(s) (E)-2-(3,5-dimethyl-1H-pyrazol-1-yl)-N'-(4-((E)-(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)diazenyl)-3-methyl-1H-pyrazol-5-yl)-2-oxoacetohydrazonoyl cyanide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C23H23N11O2
InChI InChI=1S/C23H23N11O2/c1-13-11-14(2)33(31-13)22(35)18(12-24)26-30-21-19(15(3)25-29-21)27-28-20-16(4)32(5)34(23(20)36)17-9-7-6-8-10-17/h6-11H,1-5H3,(H2,25,29,30)/b26-18+,28-27+
InChIKey HJSCLYGCCLHVKQ-ARLIEJOZSA-N
Literature Reference DOI 10.1002/ardp.201300128
Molecular Weight 485.512 g/mol
SMILES N(\N=C/(C#N)C(=O)[n]1nc(cc1C)C)c1[nH]nc(c1\N=N\C=1C(N(N(C1C)C)c1ccccc1)=O)C
SPLASH splash10-0udi-9300000000-9d03fb80ccc9588d6955
Source of Spectrum APC-346-631-5
Wiley ID 1769560