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acetamide, N-(2-chlorophenyl)-2-[[9-methyl-2-(4-methylphenyl)-5H-[1]benzopyrano[2,3-d]pyrimidin-4-yl]thio]-
SpectraBase Compound ID 6SbCkigP1WN
InChI InChI=1S/C27H22ClN3O2S/c1-16-10-12-18(13-11-16)25-30-26-20(14-19-7-5-6-17(2)24(19)33-26)27(31-25)34-15-23(32)29-22-9-4-3-8-21(22)28/h3-13H,14-15H2,1-2H3,(H,29,32)
InChIKey YFGHNCSZCVBZKW-UHFFFAOYSA-N
Mol Weight 488.01 g/mol
Molecular Formula C27H22ClN3O2S
Exact Mass 487.112126 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 8drW3Ibtc6n
Name acetamide, N-(2-chlorophenyl)-2-[[9-methyl-2-(4-methylphenyl)-5H-[1]benzopyrano[2,3-d]pyrimidin-4-yl]thio]-
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 487.112125832 u
Formula C27H22ClN3O2S
InChI InChI=1S/C27H22ClN3O2S/c1-16-10-12-18(13-11-16)25-30-26-20(14-19-7-5-6-17(2)24(19)33-26)27(31-25)34-15-23(32)29-22-9-4-3-8-21(22)28/h3-13H,14-15H2,1-2H3,(H,29,32)
InChIKey YFGHNCSZCVBZKW-UHFFFAOYSA-N
Molecular Weight 488.005 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2021_7062
Solvent DMSO-d6
Source Vendor ID: NMR/13289853