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3,4-Di-n-propylpapaverine

View entire compound with spectra: 1 NMR, and 1 MS (GC)

3,4-Di-n-propylpapaverine
SpectraBase Compound ID IIGqkuoGq93
InChI InChI=1S/C26H33NO4/c1-7-9-18-19-15-25(30-5)26(31-6)16-20(19)22(27-21(18)10-8-2)13-17-11-12-23(28-3)24(14-17)29-4/h11-12,14-16H,7-10,13H2,1-6H3
InChIKey GCICUZIYNJZADL-UHFFFAOYSA-N
Mol Weight 423.6 g/mol
Molecular Formula C26H33NO4
Exact Mass 423.240959 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID HgqVkzhz6lr
Name 3,4-di-N-Propylpapaverine
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 423.240958543 u
Formula C26H33NO4
InChI InChI=1S/C26H33NO4/c1-7-9-18-19-15-25(30-5)26(31-6)16-20(19)22(27-21(18)10-8-2)13-17-11-12-23(28-3)24(14-17)29-4/h11-12,14-16H,7-10,13H2,1-6H3
InChIKey GCICUZIYNJZADL-UHFFFAOYSA-N
Molecular Weight 423.553 g/mol
SMILES C1=2C(C(CC=3C=C(C(OC)=CC3)OC)=NC(=C1CCC)CCC)=CC(OC)=C(C2)OC