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1H-Naphtho[2,1-b]pyran-2-carbonitrile, 3-amino-1-(3,4,5-trimethoxyphenyl)-
SpectraBase Compound ID 8xK5jLje0AI
InChI InChI=1S/C23H20N2O4/c1-26-18-10-14(11-19(27-2)22(18)28-3)20-16(12-24)23(25)29-17-9-8-13-6-4-5-7-15(13)21(17)20/h4-11,20H,25H2,1-3H3
InChIKey PDKVWSUNRQULDX-UHFFFAOYSA-N
Mol Weight 388.42 g/mol
Molecular Formula C23H20N2O4
Exact Mass 388.142307 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID CwpAF848xOu
Name 1H-Naphtho[2,1-B]pyran-2-carbonitrile, 3-amino-1-(3,4,5-trimethoxyphenyl)-
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 388.142307128 u
Formula C23H20N2O4
InChI InChI=1S/C23H20N2O4/c1-26-18-10-14(11-19(27-2)22(18)28-3)20-16(12-24)23(25)29-17-9-8-13-6-4-5-7-15(13)21(17)20/h4-11,20H,25H2,1-3H3
InChIKey PDKVWSUNRQULDX-UHFFFAOYSA-N
Molecular Weight 388.423 g/mol
SMILES C1(C2=C(OC(=C1C#N)N)C=CC1=C2C=CC=C1)C1=CC(=C(C(OC)=C1)OC)OC