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

*Links on SpectraBase are not permalinks.
2-Hexylthiomethyl-4-(2-methoxycarbonylethyl)-3-M ethoxycarbonylmethyl-pyrrole
SpectraBase Compound ID GsGNpUYA4BM
InChI InChI=1S/C18H29NO4S/c1-4-5-6-7-10-24-13-16-15(11-18(21)23-3)14(12-19-16)8-9-17(20)22-2/h12,19H,4-11,13H2,1-3H3
InChIKey VQSOYCWGCBOCMS-UHFFFAOYSA-N
Mol Weight 355.49 g/mol
Molecular Formula C18H29NO4S
Exact Mass 355.18173 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 8gnatgIkhMy
Name 2-Hexylthiomethyl-4-(2-methoxycarbonylethyl)-3-M ethoxycarbonylmethyl-pyrrole
CAS Registry Number 127879-89-4
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C18H29NO4S
InChI InChI=1S/C18H29NO4S/c1-4-5-6-7-10-24-13-16-15(11-18(21)23-3)14(12-19-16)8-9-17(20)22-2/h12,19H,4-11,13H2,1-3H3
InChIKey VQSOYCWGCBOCMS-UHFFFAOYSA-N
Instrument Name Bruker AM-400
Literature Reference A.D. Miller, F.J. Leeper, A.R. Battersby, J. Chem. Soc. Perkin I 1943 (1989).
NMR Standard CDCl3
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3