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isopropyl 4-(aminocarbonyl)-3-methyl-5-{[(1-oxo-1H-2-benzopyran-3-yl)carbonyl]amino}-2-thiophenecarboxylate
SpectraBase Compound ID EV6cB0h40qg
InChI InChI=1S/C20H18N2O6S/c1-9(2)27-20(26)15-10(3)14(16(21)23)18(29-15)22-17(24)13-8-11-6-4-5-7-12(11)19(25)28-13/h4-9H,1-3H3,(H2,21,23)(H,22,24)
InChIKey XHOVMOLZHBZOEZ-UHFFFAOYSA-N
Mol Weight 414.43 g/mol
Molecular Formula C20H18N2O6S
Exact Mass 414.088557 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 89bI9XOLQMD
Name isopropyl 4-(aminocarbonyl)-3-methyl-5-{[(1-oxo-1H-2-benzopyran-3-yl)carbonyl]amino}-2-thiophenecarboxylate
Author A.V.Yarkov, IPAC, Russia
Copyright Copyright © 2016-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2016-2021 John Wiley & Sons, Inc. All Rights Reserved.
InChI InChI=1S/C20H18N2O6S/c1-9(2)27-20(26)15-10(3)14(16(21)23)18(29-15)22-17(24)13-8-11-6-4-5-7-12(11)19(25)28-13/h4-9H,1-3H3,(H2,21,23)(H,22,24)
InChIKey XHOVMOLZHBZOEZ-UHFFFAOYSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_2204
Owner Copyright (C) 2016 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright (C) 2016 John Wiley & Sons, Inc.
Sample State soluted
Solvent DMSO-d6
Source File Reference VendorID: UZI/8042933; UBI_ID: UBI-002205
Temperature 313 °C