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methyl 1-(4-isopropylphenyl)-9H-beta-carboline-3-carboxylate

View entire compound with spectra: 2 NMR

methyl 1-(4-isopropylphenyl)-9H-beta-carboline-3-carboxylate
SpectraBase Compound ID GDsmthsCi7Z
InChI InChI=1S/C22H20N2O2/c1-13(2)14-8-10-15(11-9-14)20-21-17(12-19(24-20)22(25)26-3)16-6-4-5-7-18(16)23-21/h4-13,23H,1-3H3
InChIKey IWYZGVRZIVWDRJ-UHFFFAOYSA-N
Mol Weight 344.41 g/mol
Molecular Formula C22H20N2O2
Exact Mass 344.152478 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 2mVvzVvifCa
Name Methyl 1-(4-isopropylphenyl)-9H-beta-carboline-3-carboxylate
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 344.152477890 u
Formula C22H20N2O2
InChI InChI=1S/C22H20N2O2/c1-13(2)14-8-10-15(11-9-14)20-21-17(12-19(24-20)22(25)26-3)16-6-4-5-7-18(16)23-21/h4-13,23H,1-3H3
InChIKey IWYZGVRZIVWDRJ-UHFFFAOYSA-N
Molecular Weight 344.414 g/mol
SMILES N1C=2C=CC=CC2C2=C1C(=NC(=C2)C(=O)OC)C1=CC=C(C=C1)C(C)C