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methyl 2-({[3-(2-chloro-6-fluorophenyl)-5-methyl-4-isoxazolyl]carbonyl}amino)-4-(2-naphthyl)-3-thiophenecarboxylate
SpectraBase Compound ID I5anx57QohL
InChI InChI=1S/C27H18ClFN2O4S/c1-14-21(24(31-35-14)23-19(28)8-5-9-20(23)29)25(32)30-26-22(27(33)34-2)18(13-36-26)17-11-10-15-6-3-4-7-16(15)12-17/h3-13H,1-2H3,(H,30,32)
InChIKey VYSWDVSGUKRTCX-UHFFFAOYSA-N
Mol Weight 520.96 g/mol
Molecular Formula C27H18ClFN2O4S
Exact Mass 520.065984 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 2yyptUrEsVe
Name methyl 2-({[3-(2-chloro-6-fluorophenyl)-5-methyl-4-isoxazolyl]carbonyl}amino)-4-(2-naphthyl)-3-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/C27H18ClFN2O4S/c1-14-21(24(31-35-14)23-19(28)8-5-9-20(23)29)25(32)30-26-22(27(33)34-2)18(13-36-26)17-11-10-15-6-3-4-7-16(15)12-17/h3-13H,1-2H3,(H,30,32)
InChIKey VYSWDVSGUKRTCX-UHFFFAOYSA-N
NMR Offset 15.3537
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UZI_26187_20155
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/9187963; Labnumber: U_AM_ACK/030103; UZI_ID: UZI-020163
Temperature 308 °C