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thiazolo[3,2-a]benzimidazol-3(2H)-one, 2-[[1-[(2,4-dichlorophenyl)methyl]-3-phenyl-1H-pyrazol-4-yl]methylene]-7,8-dimethyl-, (2E)-
SpectraBase Compound ID LPlkhGhmEU7
InChI InChI=1S/C28H20Cl2N4OS/c1-16-8-11-23-25(17(16)2)31-28-34(23)27(35)24(36-28)12-20-15-33(14-19-9-10-21(29)13-22(19)30)32-26(20)18-6-4-3-5-7-18/h3-13,15H,14H2,1-2H3/b24-12+
InChIKey QAZPAQNMLLHFTI-WYMPLXKRSA-N
Mol Weight 531.46 g/mol
Molecular Formula C28H20Cl2N4OS
Exact Mass 530.073488 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID AX30Jp7tcGs
Name thiazolo[3,2-a]benzimidazol-3(2H)-one, 2-[[1-[(2,4-dichlorophenyl)methyl]-3-phenyl-1H-pyrazol-4-yl]methylene]-7,8-dimethyl-, (2E)-
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 530.073487853 u
Formula C28H20Cl2N4OS
InChI InChI=1S/C28H20Cl2N4OS/c1-16-8-11-23-25(17(16)2)31-28-34(23)27(35)24(36-28)12-20-15-33(14-19-9-10-21(29)13-22(19)30)32-26(20)18-6-4-3-5-7-18/h3-13,15H,14H2,1-2H3/b24-12+
InChIKey QAZPAQNMLLHFTI-WYMPLXKRSA-N
Molecular Weight 531.461 g/mol
NMR Offset 18.0059
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_491
Solvent DMSO-d6
Source Vendor ID: ZI/8090244; Lab Info: SAD; Lab Number: SAD-e140125
Temperature 29.85 °C