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benzoic acid, 4-[5-[(E)-[4-oxo-3-(2-propenyl)-2-thioxo-5-thiazolidinylidene]methyl]-2-furanyl]-, ethyl ester
SpectraBase Compound ID LvEkQuSTNFx
InChI InChI=1S/C20H17NO4S2/c1-3-11-21-18(22)17(27-20(21)26)12-15-9-10-16(25-15)13-5-7-14(8-6-13)19(23)24-4-2/h3,5-10,12H,1,4,11H2,2H3/b17-12+
InChIKey RFDZIKXOFWSVMI-SFQUDFHCSA-N
Mol Weight 399.48 g/mol
Molecular Formula C20H17NO4S2
Exact Mass 399.0599 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID Gx4yxIhZ7Pc
Name benzoic acid, 4-[5-[(E)-[4-oxo-3-(2-propenyl)-2-thioxo-5-thiazolidinylidene]methyl]-2-furanyl]-, ethyl ester
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 399.059900375 u
Formula C20H17NO4S2
InChI InChI=1S/C20H17NO4S2/c1-3-11-21-18(22)17(27-20(21)26)12-15-9-10-16(25-15)13-5-7-14(8-6-13)19(23)24-4-2/h3,5-10,12H,1,4,11H2,2H3/b17-12+
InChIKey RFDZIKXOFWSVMI-SFQUDFHCSA-N
Molecular Weight 399.479 g/mol
NMR Offset 15.0036
NMR Spectrometer Frequency 250.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_609
Solvent DMSO-d6
Source Vendor ID: ZI/8075269; Lab Info: LP; Lab Number: LP-3513898
Temperature 23.85 °C