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sodium 1-(1,3-benzothiazol-2-yl)-3-methyl-4-(4-oxo-1,4-dihydro-2-quinolinyl)-1H-pyrazol-5-olate

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sodium 1-(1,3-benzothiazol-2-yl)-3-methyl-4-(4-oxo-1,4-dihydro-2-quinolinyl)-1H-pyrazol-5-olate
SpectraBase Compound ID 7tzlpVRYjRK
InChI InChI=1S/C20H14N4O2S.Na/c1-11-18(15-10-16(25)12-6-2-3-7-13(12)21-15)19(26)24(23-11)20-22-14-8-4-5-9-17(14)27-20;/h2-10,26H,1H3,(H,21,25);/q;+1/p-1
InChIKey QPWQFDFJGBWWFU-UHFFFAOYSA-M
Mol Weight 396.4 g/mol
Molecular Formula C20H13N4NaO2S
Exact Mass 396.065691 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 8Rn4Wp2456d
Name sodium 1-(1,3-benzothiazol-2-yl)-3-methyl-4-(4-oxo-1,4-dihydro-2-quinolinyl)-1H-pyrazol-5-olate
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/C20H14N4O2S.Na/c1-11-18(15-10-16(25)12-6-2-3-7-13(12)21-15)19(26)24(23-11)20-22-14-8-4-5-9-17(14)27-20;/h2-10,26H,1H3,(H,21,25);/q;+1/p-1
InChIKey QPWQFDFJGBWWFU-UHFFFAOYSA-M
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_11679
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: E09236; Labnumber: VGU-22877; SBI_ID: SBI-011682
Temperature 318 °C