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3-thiophenecarboxamide, 2-[[(E)-1,3-benzodioxol-5-ylmethylidene]amino]-N-(2-methoxyphenyl)-4-methyl-5-phenyl-
SpectraBase Compound ID HbYhAbAs1Vx
InChI InChI=1S/C27H22N2O4S/c1-17-24(26(30)29-20-10-6-7-11-21(20)31-2)27(34-25(17)19-8-4-3-5-9-19)28-15-18-12-13-22-23(14-18)33-16-32-22/h3-15H,16H2,1-2H3,(H,29,30)/b28-15+
InChIKey SEIMDXOLPMPLBZ-RWPZCVJISA-N
Mol Weight 470.54 g/mol
Molecular Formula C27H22N2O4S
Exact Mass 470.130028 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID G4ODQtWeH5O
Name 3-thiophenecarboxamide, 2-[[(E)-1,3-benzodioxol-5-ylmethylidene]amino]-N-(2-methoxyphenyl)-4-methyl-5-phenyl-
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 470.130028366 u
Formula C27H22N2O4S
InChI InChI=1S/C27H22N2O4S/c1-17-24(26(30)29-20-10-6-7-11-21(20)31-2)27(34-25(17)19-8-4-3-5-9-19)28-15-18-12-13-22-23(14-18)33-16-32-22/h3-15H,16H2,1-2H3,(H,29,30)/b28-15+
InChIKey SEIMDXOLPMPLBZ-RWPZCVJISA-N
Molecular Weight 470.543 g/mol
NMR Offset 18.0059
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_6634
Solvent DMSO-d6
Source Vendor ID: NMR/10220134; Lab Info: DEC; Lab Number: DEC-S000092
Temperature 29.85 °C