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2-pyridinamine, 3,4,6-trichloro-5-(trifluoromethyl)-N-[4-[(trifluoromethyl)thio]phenyl]-
SpectraBase Compound ID 85vfZUx1DuS
InChI InChI=1S/C13H5Cl3F6N2S/c14-8-7(12(17,18)19)10(16)24-11(9(8)15)23-5-1-3-6(4-2-5)25-13(20,21)22/h1-4H,(H,23,24)
InChIKey JRPQNONVZVEZKI-UHFFFAOYSA-N
Mol Weight 441.61 g/mol
Molecular Formula C13H5Cl3F6N2S
Exact Mass 439.914321 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 29DBrjstZkV
Name 2-pyridinamine, 3,4,6-trichloro-5-(trifluoromethyl)-N-[4-[(trifluoromethyl)thio]phenyl]-
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 439.914321421 u
Formula C13H5Cl3F6N2S
InChI InChI=1S/C13H5Cl3F6N2S/c14-8-7(12(17,18)19)10(16)24-11(9(8)15)23-5-1-3-6(4-2-5)25-13(20,21)22/h1-4H,(H,23,24)
InChIKey JRPQNONVZVEZKI-UHFFFAOYSA-N
Molecular Weight 441.606 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_16691
Solvent DMSO-d6
Source Vendor ID: NMR/10301506; Lab Info: SIP; Lab Number: SIP-0066