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5H-[1]benzopyrano[2,3-d]pyrimidine, 4-[[2-(3,4-dihydro-1(2H)-quinolinyl)-2-oxoethyl]thio]-2-(4-methoxyphenyl)-
SpectraBase Compound ID Fy0OaPLd7dH
InChI InChI=1S/C29H25N3O3S/c1-34-22-14-12-20(13-15-22)27-30-28-23(17-21-8-3-5-11-25(21)35-28)29(31-27)36-18-26(33)32-16-6-9-19-7-2-4-10-24(19)32/h2-5,7-8,10-15H,6,9,16-18H2,1H3
InChIKey QMZRBAISMZSZCR-UHFFFAOYSA-N
Mol Weight 495.6 g/mol
Molecular Formula C29H25N3O3S
Exact Mass 495.161663 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 5P2In9fqVSM
Name 5H-[1]benzopyrano[2,3-d]pyrimidine, 4-[[2-(3,4-dihydro-1(2H)-quinolinyl)-2-oxoethyl]thio]-2-(4-methoxyphenyl)-
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 495.161662848 u
Formula C29H25N3O3S
InChI InChI=1S/C29H25N3O3S/c1-34-22-14-12-20(13-15-22)27-30-28-23(17-21-8-3-5-11-25(21)35-28)29(31-27)36-18-26(33)32-16-6-9-19-7-2-4-10-24(19)32/h2-5,7-8,10-15H,6,9,16-18H2,1H3
InChIKey QMZRBAISMZSZCR-UHFFFAOYSA-N
Molecular Weight 495.597 g/mol
NMR Offset 17.9973
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2021_8035
Solvent DMSO-d6
Source Vendor ID: NMR/13309012