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acetamide, N-butyl-2-[[6-[[(E)-[4-[(1-methyl-1H-imidazol-2-yl)thio]-3-nitrophenyl]methylidene]amino]-2-benzothiazolyl]thio]-
SpectraBase Compound ID 57m3NQzTBBG
InChI InChI=1S/C24H24N6O3S3/c1-3-4-9-25-22(31)15-34-24-28-18-7-6-17(13-21(18)36-24)27-14-16-5-8-20(19(12-16)30(32)33)35-23-26-10-11-29(23)2/h5-8,10-14H,3-4,9,15H2,1-2H3,(H,25,31)/b27-14+
InChIKey DQWDNKVCMXRWSM-MZJWZYIUSA-N
Mol Weight 540.68 g/mol
Molecular Formula C24H24N6O3S3
Exact Mass 540.107202 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 9DOsuA4GxVZ
Name acetamide, N-butyl-2-[[6-[[(E)-[4-[(1-methyl-1H-imidazol-2-yl)thio]-3-nitrophenyl]methylidene]amino]-2-benzothiazolyl]thio]-
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 540.107202176 u
Formula C24H24N6O3S3
InChI InChI=1S/C24H24N6O3S3/c1-3-4-9-25-22(31)15-34-24-28-18-7-6-17(13-21(18)36-24)27-14-16-5-8-20(19(12-16)30(32)33)35-23-26-10-11-29(23)2/h5-8,10-14H,3-4,9,15H2,1-2H3,(H,25,31)/b27-14+
InChIKey DQWDNKVCMXRWSM-MZJWZYIUSA-N
Molecular Weight 540.675 g/mol
NMR Offset 18.0059
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_1129
Solvent DMSO-d6
Source Vendor ID: ZI/7073051; Lab Info: LP; Lab Number: LP-0602509
Temperature 29.85 °C