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4-Hydroxy-6-methyl-3-(1-(4-methoxyphenyl)-3-(4-nitrophenyl)-2-propen-1-yl)-2-pyrone
SpectraBase Compound ID JeK2s0Jr9s1
InChI InChI=1S/C22H19NO6/c1-14-13-20(24)21(22(25)29-14)19(16-6-10-18(28-2)11-7-16)12-5-15-3-8-17(9-4-15)23(26)27/h3-13,19,24H,1-2H3/b12-5+
InChIKey DVPVLAJHNXWKAQ-LFYBBSHMSA-N
Mol Weight 393.4 g/mol
Molecular Formula C22H19NO6
Exact Mass 393.121237 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 8lu9vWfxPWm
Name 4-Hydroxy-6-methyl-3-(1-(4-methoxyphenyl)-3-(4-nitrophenyl)-2-propen-1-yl)-2-pyrone
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 393.121237330 u
Formula C22H19NO6
InChI InChI=1S/C22H19NO6/c1-14-13-20(24)21(22(25)29-14)19(16-6-10-18(28-2)11-7-16)12-5-15-3-8-17(9-4-15)23(26)27/h3-13,19,24H,1-2H3/b12-5+
InChIKey DVPVLAJHNXWKAQ-LFYBBSHMSA-N
Molecular Weight 393.395 g/mol
SMILES C=1(C(OC(=CC1O)C)=O)C(\C=C\C=1C=CC(N(=O)=O)=CC1)C1=CC=C(C=C1)OC