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1-(4,6-Bis[trichloromethyl]-1,3,5-triazin-2-yl)-3-(4-chloro-phenyl)-guanidine
SpectraBase Compound ID 4SM69SmesTu
InChI InChI=1S/C12H7Cl7N6/c13-5-1-3-6(4-2-5)21-9(20)25-10-23-7(11(14,15)16)22-8(24-10)12(17,18)19/h1-4H,(H3,20,21,22,23,24,25)
InChIKey HVGHSJCCEYNCPO-UHFFFAOYSA-N
Mol Weight 483.4 g/mol
Molecular Formula C12H7Cl7N6
Exact Mass 479.855188 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID JjdUB47rcIn
Name 1-(4,6-Bis[trichloromethyl]-1,3,5-triazin-2-yl)-3-(4-chloro-phenyl)-guanidine
CAS Registry Number 108845-44-9
Comments REASSIGNED A.H.
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C12H7Cl7N6
InChI InChI=1S/C12H7Cl7N6/c13-5-1-3-6(4-2-5)21-9(20)25-10-23-7(11(14,15)16)22-8(24-10)12(17,18)19/h1-4H,(H3,20,21,22,23,24,25)
InChIKey HVGHSJCCEYNCPO-UHFFFAOYSA-N
Instrument Name Bruker WH-90
NMR Standard DMSO-D6
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent DMSO-D6