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thioimidocarbonic acid, O-m-chlorophenyl ester, S,S-diester with 6-(m-chlorophenoxy)-s-triazine-2,4-dithiol
SpectraBase Compound ID AZxp89iVvWP
InChI InChI=1S/C23H14Cl3N5O3S2/c24-13-4-1-7-16(10-13)32-19(27)35-22-29-21(34-18-9-3-6-15(26)12-18)30-23(31-22)36-20(28)33-17-8-2-5-14(25)11-17/h1-12,27-28H
InChIKey YZEJTUUGZCRKPQ-UHFFFAOYSA-N
Mol Weight 578.88 g/mol
Molecular Formula C23H14Cl3N5O3S2
Exact Mass 576.960365 g/mol

1H Nuclear Magnetic Resonance (NMR) Chemical Shifts

1H Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 70D6M1kX9WF
Name thioimidocarbonic acid, O-m-chlorophenyl ester, S,S-diester with 6-(m-chlorophenoxy)-s-triazine-2,4-dithiol
Source of Sample E. Grigat, Bayer AG, Leverkusen, Germany
Copyright Copyright © 2009-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C23H14Cl3N5O3S2
InChI InChI=1S/C23H14Cl3N5O3S2/c24-13-4-1-7-16(10-13)32-19(27)35-22-29-21(34-18-9-3-6-15(26)12-18)30-23(31-22)36-20(28)33-17-8-2-5-14(25)11-17/h1-12,27-28H
InChIKey YZEJTUUGZCRKPQ-UHFFFAOYSA-N
Instrument Name Varian A-60
Sadtler NMR Number 5358M
Solvent Acetone