For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.

carbamimidothioic acid, N-[4-(chlorodifluoromethoxy)phenyl]-N'-[(E)-phenylmethyl]-, 1-(3,5-dichlorophenyl)-2,5-dioxo-3-pyrrolidinyl ester

View entire compound with spectra: 1 NMR, and 1 MS (GC)

carbamimidothioic acid, N-[4-(chlorodifluoromethoxy)phenyl]-N'-[(E)-phenylmethyl]-, 1-(3,5-dichlorophenyl)-2,5-dioxo-3-pyrrolidinyl ester
SpectraBase Compound ID Dti7caLvuKf
InChI InChI=1S/C25H18Cl3F2N3O3S/c26-16-10-17(27)12-19(11-16)33-22(34)13-21(23(33)35)37-24(31-14-15-4-2-1-3-5-15)32-18-6-8-20(9-7-18)36-25(28,29)30/h1-12,21H,13-14H2,(H,31,32)
InChIKey GKGQUALCWFFNKH-UHFFFAOYSA-N
Mol Weight 584.85 g/mol
Molecular Formula C25H18Cl3F2N3O3S
Exact Mass 583.010252 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID 9FEC7JRdpZD
Name carbamimidothioic acid, N-[4-(chlorodifluoromethoxy)phenyl]-N'-[(E)-phenylmethyl]-, 1-(3,5-dichlorophenyl)-2,5-dioxo-3-pyrrolidinyl ester
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 583.010252049 u
Formula C25H18Cl3F2N3O3S
InChI InChI=1S/C25H18Cl3F2N3O3S/c26-16-10-17(27)12-19(11-16)33-22(34)13-21(23(33)35)37-24(31-14-15-4-2-1-3-5-15)32-18-6-8-20(9-7-18)36-25(28,29)30/h1-12,21H,13-14H2,(H,31,32)
InChIKey GKGQUALCWFFNKH-UHFFFAOYSA-N
Molecular Weight 584.853 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_4296
Solvent DMSO-d6
Source Vendor ID: NMR/9296359; Lab Info: PE; Lab Number: PE/9044841