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3-[5-(3-chloro-4-methoxyanilino)-1,3,4-thiadiazol-2-yl]-5-(hydroxymethyl)-8-methyl-2H-pyrano[2,3-c]pyridin-2-one
SpectraBase Compound ID 5GNLKzmtCRL
InChI InChI=1S/C19H15ClN4O4S/c1-9-16-12(10(8-25)7-21-9)6-13(18(26)28-16)17-23-24-19(29-17)22-11-3-4-15(27-2)14(20)5-11/h3-7,25H,8H2,1-2H3,(H,22,24)
InChIKey URGKJERNYJYWBB-UHFFFAOYSA-N
Mol Weight 430.87 g/mol
Molecular Formula C19H15ClN4O4S
Exact Mass 430.050254 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 5hhuS6kqSiT
Name 3-[5-(3-chloro-4-methoxyanilino)-1,3,4-thiadiazol-2-yl]-5-(hydroxymethyl)-8-methyl-2H-pyrano[2,3-c]pyridin-2-one
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 430.050253849 u
Formula C19H15ClN4O4S
InChI InChI=1S/C19H15ClN4O4S/c1-9-16-12(10(8-25)7-21-9)6-13(18(26)28-16)17-23-24-19(29-17)22-11-3-4-15(27-2)14(20)5-11/h3-7,25H,8H2,1-2H3,(H,22,24)
InChIKey URGKJERNYJYWBB-UHFFFAOYSA-N
Molecular Weight 430.866 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2020_7278
Solvent DMSO-d6
Source Vendor ID: NMR/13218016