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

*Links on SpectraBase are not permalinks.
Ethaverine-M (HO-) AC
SpectraBase Compound ID 3Nzcv6WB5aB
InChI InChI=1S/C26H31NO6/c1-6-29-22-15-19-10-11-27-21(20(19)16-23(22)30-7-2)12-18-13-24(31-8-3)26(32-9-4)25(14-18)33-17(5)28/h10-11,13-16H,6-9,12H2,1-5H3
InChIKey BUNZMNAHOKUPML-UHFFFAOYSA-N
Mol Weight 453.54 g/mol
Molecular Formula C26H31NO6
Exact Mass 453.215138 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 6472uGZKCNM
Name Ethaverine-m (ho-) ac P1587
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 453.215137716 u
Formula C26H31NO6
InChI InChI=1S/C26H31NO6/c1-6-29-22-15-19-10-11-27-21(20(19)16-23(22)30-7-2)12-18-13-24(31-8-3)26(32-9-4)25(14-18)33-17(5)28/h10-11,13-16H,6-9,12H2,1-5H3
InChIKey BUNZMNAHOKUPML-UHFFFAOYSA-N
Molecular Weight 453.535 g/mol
SMILES C=1C2=CC=NC(CC=3C=C(OCC)C(=C(C3)OC(C)=O)OCC)=C2C=C(OCC)C1OCC