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pyridine, 4-[[3,5-bis(1,1-dimethylethyl)-4-hydroxyphenyl]thio]-2,3,5-trichloro-6-[2-[[[4-(trifluoromethyl)phenyl]amino]carbonothioyl]hydrazino]-

View entire compound with spectra: 1 NMR

pyridine, 4-[[3,5-bis(1,1-dimethylethyl)-4-hydroxyphenyl]thio]-2,3,5-trichloro-6-[2-[[[4-(trifluoromethyl)phenyl]amino]carbonothioyl]hydrazino]-
SpectraBase Compound ID KhWfKdhCsyY
InChI InChI=1S/C27H28Cl3F3N4OS2/c1-25(2,3)16-11-15(12-17(20(16)38)26(4,5)6)40-21-18(28)22(30)35-23(19(21)29)36-37-24(39)34-14-9-7-13(8-10-14)27(31,32)33/h7-12,38H,1-6H3,(H,35,36)(H2,34,37,39)
InChIKey IDKBKKSYPNXFEB-UHFFFAOYSA-N
Mol Weight 652.02 g/mol
Molecular Formula C27H28Cl3F3N4OS2
Exact Mass 650.072221 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID JG6LyafgCge
Name pyridine, 4-[[3,5-bis(1,1-dimethylethyl)-4-hydroxyphenyl]thio]-2,3,5-trichloro-6-[2-[[[4-(trifluoromethyl)phenyl]amino]carbonothioyl]hydrazino]-
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 650.072221474 u
Formula C27H28Cl3F3N4OS2
InChI InChI=1S/C27H28Cl3F3N4OS2/c1-25(2,3)16-11-15(12-17(20(16)38)26(4,5)6)40-21-18(28)22(30)35-23(19(21)29)36-37-24(39)34-14-9-7-13(8-10-14)27(31,32)33/h7-12,38H,1-6H3,(H,35,36)(H2,34,37,39)
InChIKey IDKBKKSYPNXFEB-UHFFFAOYSA-N
Molecular Weight 652.022 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_15708
Solvent DMSO-d6
Source Vendor ID: NMR/10301513; Lab Info: SIP; Lab Number: SIP-0073