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6-Amino-4-[5-(2-cyanophenyl)-2-furyl]-3-methyl-1,4-dihydropyrano[2,3-C]pyrazole-5-carbonitrile
SpectraBase Compound ID 7qaWacFc40n
InChI InChI=1S/C19H13N5O2/c1-10-16-17(13(9-21)18(22)26-19(16)24-23-10)15-7-6-14(25-15)12-5-3-2-4-11(12)8-20/h2-7,17H,22H2,1H3,(H,23,24)
InChIKey LQCITFUQIIMVHZ-UHFFFAOYSA-N
Mol Weight 343.35 g/mol
Molecular Formula C19H13N5O2
Exact Mass 343.106925 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 8ylBkBMrnMB
Name 6-Amino-4-[5-(2-cyanophenyl)-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 343.106924677 u
Formula C19H13N5O2
InChI InChI=1S/C19H13N5O2/c1-10-16-17(13(9-21)18(22)26-19(16)24-23-10)15-7-6-14(25-15)12-5-3-2-4-11(12)8-20/h2-7,17H,22H2,1H3,(H,23,24)
InChIKey LQCITFUQIIMVHZ-UHFFFAOYSA-N
SMILES NC1=C(C(C2=C(O1)NN=C2C)C=1OC(C2=C(C#N)C=CC=C2)=CC1)C#N