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

*Links on SpectraBase are not permalinks.

benzoic acid, 4-[[(Z)-(1-ethyltetrahydro-4,6-dioxo-2-thioxo-5(2H)-pyrimidinylidene)methyl]amino]-, 2-(diethylamino)ethyl ester

View entire compound with spectra: 1 NMR

benzoic acid, 4-[[(Z)-(1-ethyltetrahydro-4,6-dioxo-2-thioxo-5(2H)-pyrimidinylidene)methyl]amino]-, 2-(diethylamino)ethyl ester
SpectraBase Compound ID 2rKSFwOK5Qk
InChI InChI=1S/C20H26N4O4S/c1-4-23(5-2)11-12-28-19(27)14-7-9-15(10-8-14)21-13-16-17(25)22-20(29)24(6-3)18(16)26/h7-10,13,21H,4-6,11-12H2,1-3H3,(H,22,25,29)/b16-13-
InChIKey QCTIAVXAVGGGFV-SSZFMOIBSA-N
Mol Weight 418.51 g/mol
Molecular Formula C20H26N4O4S
Exact Mass 418.167477 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 7Pkeh8kICm9
Name benzoic acid, 4-[[(Z)-(1-ethyltetrahydro-4,6-dioxo-2-thioxo-5(2H)-pyrimidinylidene)methyl]amino]-, 2-(diethylamino)ethyl 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 418.167476503 u
Formula C20H26N4O4S
InChI InChI=1S/C20H26N4O4S/c1-4-23(5-2)11-12-28-19(27)14-7-9-15(10-8-14)21-13-16-17(25)22-20(29)24(6-3)18(16)26/h7-10,13,21H,4-6,11-12H2,1-3H3,(H,22,25,29)/b16-13-
InChIKey QCTIAVXAVGGGFV-SSZFMOIBSA-N
Molecular Weight 418.512 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_17759
Solvent DMSO-d6
Source Vendor ID: NMR/11270707; Lab Info: LP; Lab Number: LP-1701213