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3-({[(3-methoxy-2-naphthoyl)amino]carbothioyl}amino)-2-methylbenzoic acid
SpectraBase Compound ID 6NxVH8CFTh3
InChI InChI=1S/C21H18N2O4S/c1-12-15(20(25)26)8-5-9-17(12)22-21(28)23-19(24)16-10-13-6-3-4-7-14(13)11-18(16)27-2/h3-11H,1-2H3,(H,25,26)(H2,22,23,24,28)
InChIKey PBQSCEQFVASBQP-UHFFFAOYSA-N
Mol Weight 394.45 g/mol
Molecular Formula C21H18N2O4S
Exact Mass 394.098728 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 3amD55iy307
Name 3-({[(3-methoxy-2-naphthoyl)amino]carbothioyl}amino)-2-methylbenzoic acid
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/C21H18N2O4S/c1-12-15(20(25)26)8-5-9-17(12)22-21(28)23-19(24)16-10-13-6-3-4-7-14(13)11-18(16)27-2/h3-11H,1-2H3,(H,25,26)(H2,22,23,24,28)
InChIKey PBQSCEQFVASBQP-UHFFFAOYSA-N
NMR Offset 18.0059
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_18461
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: D32777; Labnumber: SPMOS1-19549; SBI_ID: SBI-018464
Temperature 306 °C