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6-Amino-4-[5-(2,4-dichlorophenyl)-2-furyl]-3-methyl-1,4-dihydropyrano[2,3-C]pyrazole-5-carbonitrile
SpectraBase Compound ID DekDxR6Epsu
InChI InChI=1S/C18H12Cl2N4O2/c1-8-15-16(11(7-21)17(22)26-18(15)24-23-8)14-5-4-13(25-14)10-3-2-9(19)6-12(10)20/h2-6,16H,22H2,1H3,(H,23,24)
InChIKey RBWLCFUIYRKXEN-UHFFFAOYSA-N
Mol Weight 387.23 g/mol
Molecular Formula C18H12Cl2N4O2
Exact Mass 386.033731 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID ABd0DTrrOXN
Name 6-Amino-4-[5-(2,4-dichlorophenyl)-2-furyl]-3-methyl-1,4-dihydropyrano[2,3-C]pyrazole-5-carbonitrile
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 386.033731040 u
Formula C18H12Cl2N4O2
InChI InChI=1S/C18H12Cl2N4O2/c1-8-15-16(11(7-21)17(22)26-18(15)24-23-8)14-5-4-13(25-14)10-3-2-9(19)6-12(10)20/h2-6,16H,22H2,1H3,(H,23,24)
InChIKey RBWLCFUIYRKXEN-UHFFFAOYSA-N
Molecular Weight 387.226 g/mol
SMILES NC1=C(C(C2=C(O1)NN=C2C)C=1OC(C2=C(C=C(C=C2)Cl)Cl)=CC1)C#N