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2-Amino-4-(2,4-dimethoxyphenyl)-4H-benzo[h]chromene-3-carbonitrile
SpectraBase Compound ID LM52HZ7ijM9
InChI InChI=1S/C22H18N2O3/c1-25-14-8-10-16(19(11-14)26-2)20-17-9-7-13-5-3-4-6-15(13)21(17)27-22(24)18(20)12-23/h3-11,20H,24H2,1-2H3
InChIKey HDDYCMPDTFLIKX-UHFFFAOYSA-N
Mol Weight 358.4 g/mol
Molecular Formula C22H18N2O3
Exact Mass 358.131742 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 58SC7tscPJz
Name 2-Amino-4-(2,4-dimethoxyphenyl)-4H-benzo[H]chromene-3-carbonitrile
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 358.131742445 u
Formula C22H18N2O3
InChI InChI=1S/C22H18N2O3/c1-25-14-8-10-16(19(11-14)26-2)20-17-9-7-13-5-3-4-6-15(13)21(17)27-22(24)18(20)12-23/h3-11,20H,24H2,1-2H3
InChIKey HDDYCMPDTFLIKX-UHFFFAOYSA-N
Molecular Weight 358.397 g/mol
SMILES C1(=C(C(C=2C=CC=3C(C2O1)=CC=CC3)C=1C(=CC(=CC1)OC)OC)C#N)N