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Harmol, bis(N-butyl)-
SpectraBase Compound ID BoOai35PRNd
InChI InChI=1S/C20H26N2O/c1-4-6-12-22-19-14-16(23-13-7-5-2)8-9-17(19)18-10-11-21-15(3)20(18)22/h8-11,14H,4-7,12-13H2,1-3H3
InChIKey FCJJXXBMEZMRED-UHFFFAOYSA-N
Mol Weight 310.44 g/mol
Molecular Formula C20H26N2O
Exact Mass 310.204513 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 9kGSGivUJxk
Name Harmol, bis(N-butyl)-
Comments Computed using HOSE algorithm
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Exact Mass 310.204513464 u
Formula C20H26N2O
InChI InChI=1S/C20H26N2O/c1-4-6-12-22-19-14-16(23-13-7-5-2)8-9-17(19)18-10-11-21-15(3)20(18)22/h8-11,14H,4-7,12-13H2,1-3H3
InChIKey FCJJXXBMEZMRED-UHFFFAOYSA-N
Molecular Weight 310.441 g/mol
SMILES C1=2C3=C(C=C(C=C3)OCCCC)N(C1=C(C)N=CC2)CCCC