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4,4-Bis(trifluoromethyl)-2-(4-tolyl)-6-trichloromethyl-4H-1,3,5-thiadiazine

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4,4-Bis(trifluoromethyl)-2-(4-tolyl)-6-trichloromethyl-4H-1,3,5-thiadiazine
SpectraBase Compound ID 3UPkTTcgUDT
InChI InChI=1S/C13H7Cl3F6N2S/c1-6-2-4-7(5-3-6)8-23-11(12(17,18)19,13(20,21)22)24-9(25-8)10(14,15)16/h2-5H,1H3
InChIKey ICBDNWQHXORFEC-UHFFFAOYSA-N
Mol Weight 443.62 g/mol
Molecular Formula C13H7Cl3F6N2S
Exact Mass 441.929971 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 9GrUb2X3YN8
Name 4,4-Bis(trifluoromethyl)-2-(4-tolyl)-6-trichloromethyl-4H-1,3,5-thiadiazine
CAS Registry Number 107364-25-0
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C13H7Cl3F6N2S
InChI InChI=1S/C13H7Cl3F6N2S/c1-6-2-4-7(5-3-6)8-23-11(12(17,18)19,13(20,21)22)24-9(25-8)10(14,15)16/h2-5H,1H3
InChIKey ICBDNWQHXORFEC-UHFFFAOYSA-N
Instrument Name Jeol FX-60
Literature Reference K. Burger, E. Huber, W. Schoentag, H. Partscht, Chemiker-Zeitung 110, 79 (1986).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3