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6-[N,N-bis(Ethoxycarbonyl)amino]-4-(p-chlorophenyl)-5-cyano-3-methyl-1-phenyl-4H-pyrano[2,3-c]pyrazole
SpectraBase Compound ID G9cru8fOoYc
InChI InChI=1S/C26H23ClN4O5/c1-4-34-25(32)30(26(33)35-5-2)23-20(15-28)22(17-11-13-18(27)14-12-17)21-16(3)29-31(24(21)36-23)19-9-7-6-8-10-19/h6-14,22H,4-5H2,1-3H3
InChIKey FOHOXHLXMWHZOB-UHFFFAOYSA-N
Mol Weight 506.95 g/mol
Molecular Formula C26H23ClN4O5
Exact Mass 506.135698 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2AXQRNmsuWa
Name 6-[N,N-bis(Ethoxycarbonyl)amino]-4-(p-chlorophenyl)-5-cyano-3-methyl-1-phenyl-4H-pyrano[2,3-c]pyrazole
Alternate Name(s) Diethyl 4-(4-chlorophenyl)-5-cyano-3-methyl-1-phenyl-1,4-dihydropyrano[2,3-c]pyrazol-6-ylimidodicarbonate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C26H23ClN4O5
InChI InChI=1S/C26H23ClN4O5/c1-4-34-25(32)30(26(33)35-5-2)23-20(15-28)22(17-11-13-18(27)14-12-17)21-16(3)29-31(24(21)36-23)19-9-7-6-8-10-19/h6-14,22H,4-5H2,1-3H3
InChIKey FOHOXHLXMWHZOB-UHFFFAOYSA-N
Molecular Weight 506.946 g/mol
SMILES c12c(C(c3ccc(cc3)Cl)C(=C(O1)N(C(=O)OCC)C(=O)OCC)C#N)c(C)n[n]2-c1ccccc1
SPLASH splash10-0a4s-3660090000-934f444f8f5af537d193
Source of Spectrum Y5-64-17-7
Wiley ID 879438