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2H-pyrano[2,3-c]pyridin-2-one, 3-[5-[(5-chloro-2,4-dimethoxyphenyl)amino]-1,3,4-thiadiazol-2-yl]-5-(hydroxymethyl)-8-methyl-
SpectraBase Compound ID CKVbvoQL0vm
InChI InChI=1S/C20H17ClN4O5S/c1-9-17-11(10(8-26)7-22-9)4-12(19(27)30-17)18-24-25-20(31-18)23-14-5-13(21)15(28-2)6-16(14)29-3/h4-7,26H,8H2,1-3H3,(H,23,25)
InChIKey BKYXRCZXKAMHSF-UHFFFAOYSA-N
Mol Weight 460.89 g/mol
Molecular Formula C20H17ClN4O5S
Exact Mass 460.060819 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 95NCjKB2Wm0
Name 2H-pyrano[2,3-c]pyridin-2-one, 3-[5-[(5-chloro-2,4-dimethoxyphenyl)amino]-1,3,4-thiadiazol-2-yl]-5-(hydroxymethyl)-8-methyl-
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 460.060818532 u
Formula C20H17ClN4O5S
InChI InChI=1S/C20H17ClN4O5S/c1-9-17-11(10(8-26)7-22-9)4-12(19(27)30-17)18-24-25-20(31-18)23-14-5-13(21)15(28-2)6-16(14)29-3/h4-7,26H,8H2,1-3H3,(H,23,25)
InChIKey BKYXRCZXKAMHSF-UHFFFAOYSA-N
Molecular Weight 460.892 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2021_6368
Solvent DMSO-d6
Source Vendor ID: NMR/13289548