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Pyrrolo[2,1-a]isoquinoline-2-carboxamide, N-[2-(3,4-dimethoxyphenyl)ethyl]-1-[[[2-(3,4-dimethoxyphenyl)ethyl]amino]methy l]-5,6-dihydro-8,9-dimethoxy-
SpectraBase Compound ID 7cxW5a2kgBd
InChI InChI=1S/C36H43N3O7/c1-41-29-9-7-23(17-31(29)43-3)11-14-37-21-27-28(36(40)38-15-12-24-8-10-30(42-2)32(18-24)44-4)22-39-16-13-25-19-33(45-5)34(46-6)20-26(25)35(27)39/h7-10,17-20,22,37H,11-16,21H2,1-6H3,(H,38,40)
InChIKey HVICPVUJKDYGGN-UHFFFAOYSA-N
Mol Weight 629.8 g/mol
Molecular Formula C36H43N3O7
Exact Mass 629.310101 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID IbRqGgFFn06
Name Pyrrolo[2,1-A]isoquinoline-2-carboxamide, N-[2-(3,4-dimethoxyphenyl)ethyl]-1-[[[2-(3,4-dimethoxyphenyl)ethyl]amino]methy L]-5,6-dihydro-8,9-dimethoxy-
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 629.310100730 u
Formula C36H43N3O7
InChI InChI=1S/C36H43N3O7/c1-41-29-9-7-23(17-31(29)43-3)11-14-37-21-27-28(36(40)38-15-12-24-8-10-30(42-2)32(18-24)44-4)22-39-16-13-25-19-33(45-5)34(46-6)20-26(25)35(27)39/h7-10,17-20,22,37H,11-16,21H2,1-6H3,(H,38,40)
InChIKey HVICPVUJKDYGGN-UHFFFAOYSA-N
Molecular Weight 629.754 g/mol
SMILES C=1(C(=C2C3=C(C=C(C(=C3)OC)OC)CCN2C1)CNCCC=1C=C(OC)C(=CC1)OC)C(=O)NCCC=1C=C(OC)C(=CC1)OC