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

*Links on SpectraBase are not permalinks.

3-(3-ETHOXYCARBONYLTHIOUREIDO)-2-METHOXYMETHYL-1-METHYLPYRROL

View entire compound with spectra: 2 NMR, and 1 FTIR

3-(3-ETHOXYCARBONYLTHIOUREIDO)-2-METHOXYMETHYL-1-METHYLPYRROL
SpectraBase Compound ID 9QisTPylPi2
InChI InChI=1S/C15H22N4O5S2/c1-5-23-14(20)17-12(25)11-10(7-9(8-22-4)19(11)3)16-13(26)18-15(21)24-6-2/h7H,5-6,8H2,1-4H3,(H,17,20,25)(H2,16,18,21,26)
InChIKey SVTQEHWTYJXABE-UHFFFAOYSA-N
Mol Weight 402.48 g/mol
Molecular Formula C15H22N4O5S2
Exact Mass 402.103162 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

View the Full Spectrum for FREE!

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

SpectraBase Spectrum ID Ks8WSAlnBBQ
Name 3-(3-Ethoxycarbonyl-thioureido)-5-methoxymethyl-1-methyl-pyrrole-2-(N-ethoxycarbonyl-thiocarboxamide)
CAS Registry Number 77478-91-2
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C15H22N4O5S2
InChI InChI=1S/C15H22N4O5S2/c1-5-23-14(20)17-12(25)11-10(7-9(8-22-4)19(11)3)16-13(26)18-15(21)24-6-2/h7H,5-6,8H2,1-4H3,(H,17,20,25)(H2,16,18,21,26)
InChIKey SVTQEHWTYJXABE-UHFFFAOYSA-N
Instrument Name Jeol FX-100
Literature Reference L. Grehn, Chemica Scripta 16, 77 (1980).
NMR Standard DMSO-D6
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent DMSO-D6