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(-)-1,2,3,4-tetrahydroisoquinoline, 2-[(1-phenethyl)aminocarbonyl]-1-

View entire compound with spectra: 1 NMR

(-)-1,2,3,4-tetrahydroisoquinoline, 2-[(1-phenethyl)aminocarbonyl]-1-
SpectraBase Compound ID CYOcwyhL9jE
InChI InChI=1S/C27H30N2O4/c1-18(19-10-6-4-7-11-19)28-27(31)29-15-14-21-16-23(32-2)24(33-3)17-22(21)25(29)26(30)20-12-8-5-9-13-20/h4-13,16-18,25-26,30H,14-15H2,1-3H3,(H,28,31)
InChIKey QSNSKNBEGCOCAC-UHFFFAOYSA-N
Mol Weight 446.55 g/mol
Molecular Formula C27H30N2O4
Exact Mass 446.220557 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 2mzDqq5dD5U
Name (-)-1,2,3,4-tetrahydroisoquinoline, 2-[(1-phenethyl)aminocarbonyl]-1-
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 446.220557450 u
Formula C27H30N2O4
InChI InChI=1S/C27H30N2O4/c1-18(19-10-6-4-7-11-19)28-27(31)29-15-14-21-16-23(32-2)24(33-3)17-22(21)25(29)26(30)20-12-8-5-9-13-20/h4-13,16-18,25-26,30H,14-15H2,1-3H3,(H,28,31)
InChIKey QSNSKNBEGCOCAC-UHFFFAOYSA-N
Molecular Weight 446.547 g/mol
SMILES C1(OC)=CC2=C(C(N(CC2)C(=O)NC(C)C2=CC=CC=C2)C(C2=CC=CC=C2)O)C=C1OC