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N-(3-bromo-4-methoxybenzoyl)-N'-[2-(4-butylphenyl)-2H-1,2,3-benzotriazol-5-yl]thiourea

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N-(3-bromo-4-methoxybenzoyl)-N'-[2-(4-butylphenyl)-2H-1,2,3-benzotriazol-5-yl]thiourea
SpectraBase Compound ID 5mdTJ3XJkgp
InChI InChI=1S/C25H24BrN5O2S/c1-3-4-5-16-6-10-19(11-7-16)31-29-21-12-9-18(15-22(21)30-31)27-25(34)28-24(32)17-8-13-23(33-2)20(26)14-17/h6-15H,3-5H2,1-2H3,(H2,27,28,32,34)
InChIKey HAERJHIOCCNCSK-UHFFFAOYSA-N
Mol Weight 538.46 g/mol
Molecular Formula C25H24BrN5O2S
Exact Mass 537.083409 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID HdnkX3cLJgw
Name N-(3-bromo-4-methoxybenzoyl)-N'-[2-(4-butylphenyl)-2H-1,2,3-benzotriazol-5-yl]thiourea
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/C25H24BrN5O2S/c1-3-4-5-16-6-10-19(11-7-16)31-29-21-12-9-18(15-22(21)30-31)27-25(34)28-24(32)17-8-13-23(33-2)20(26)14-17/h6-15H,3-5H2,1-2H3,(H2,27,28,32,34)
InChIKey HAERJHIOCCNCSK-UHFFFAOYSA-N
NMR Offset 14.9921
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_13
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: 61327; UBI_ID: UBI-000014
Temperature 313 °C