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furo[3,4-c]pyridin-3(1H)-one, 4-mercapto-6-methyl-1-[[5-(3-nitrophenyl)-2-furanyl]methylene]-, (1E)-
SpectraBase Compound ID 6pZ3kJ27fdS
InChI InChI=1S/C19H12N2O5S/c1-10-7-14-16(26-19(22)17(14)18(27)20-10)9-13-5-6-15(25-13)11-3-2-4-12(8-11)21(23)24/h2-9H,1H3,(H,20,27)/b16-9+
InChIKey XLTAISKMEARWKT-CXUHLZMHSA-N
Mol Weight 380.37 g/mol
Molecular Formula C19H12N2O5S
Exact Mass 380.046693 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID AplmmuBsaG
Name furo[3,4-c]pyridin-3(1H)-one, 4-mercapto-6-methyl-1-[[5-(3-nitrophenyl)-2-furanyl]methylene]-, (1E)-
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 380.046692663 u
Formula C19H12N2O5S
InChI InChI=1S/C19H12N2O5S/c1-10-7-14-16(26-19(22)17(14)18(27)20-10)9-13-5-6-15(25-13)11-3-2-4-12(8-11)21(23)24/h2-9H,1H3,(H,20,27)/b16-9+
InChIKey XLTAISKMEARWKT-CXUHLZMHSA-N
Molecular Weight 380.374 g/mol
NMR Offset 16.1752
NMR Spectrometer Frequency 200.133
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_2122
Solvent DMSO-d6
Source Vendor ID: NMR/9244486; Lab Info: KE; Lab Number: KE-0000944
Temperature 39.85 °C