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6-Amino-4-(4-chlorophenyl)-3-(3-methoxyphenyl)-1,4-dihydropyrano[2,3-C]pyrazole-5-carbonitrile
SpectraBase Compound ID EjffDTzRIld
InChI InChI=1S/C20H15ClN4O2/c1-26-14-4-2-3-12(9-14)18-17-16(11-5-7-13(21)8-6-11)15(10-22)19(23)27-20(17)25-24-18/h2-9,16H,23H2,1H3,(H,24,25)
InChIKey MYEICCSKSUHXDY-UHFFFAOYSA-N
Mol Weight 378.82 g/mol
Molecular Formula C20H15ClN4O2
Exact Mass 378.088353 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID HhQVBBCKyrU
Name 6-Amino-4-(4-chlorophenyl)-3-(3-methoxyphenyl)-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 378.088353437 u
Formula C20H15ClN4O2
InChI InChI=1S/C20H15ClN4O2/c1-26-14-4-2-3-12(9-14)18-17-16(11-5-7-13(21)8-6-11)15(10-22)19(23)27-20(17)25-24-18/h2-9,16H,23H2,1H3,(H,24,25)
InChIKey MYEICCSKSUHXDY-UHFFFAOYSA-N
Molecular Weight 378.819 g/mol
SMILES NC1=C(C(C2=C(O1)NN=C2C=1C=C(OC)C=CC1)C1=CC=C(C=C1)Cl)C#N