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2-(o-Chlorobenzyl)-1,2,3,4-tetrahydro-7-methoxy-1-methylene-.beta.-carboline

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

2-(o-Chlorobenzyl)-1,2,3,4-tetrahydro-7-methoxy-1-methylene-.beta.-carboline
SpectraBase Compound ID HYPYqUuFoJK
InChI InChI=1S/C20H19ClN2O/c1-13-20-17(16-8-7-15(24-2)11-19(16)22-20)9-10-23(13)12-14-5-3-4-6-18(14)21/h3-8,11,22H,1,9-10,12H2,2H3
InChIKey CENJYJPCBVUWPJ-UHFFFAOYSA-N
Mol Weight 338.84 g/mol
Molecular Formula C20H19ClN2O
Exact Mass 338.118591 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 7aCGjaSysiC
Name 2-(o-Chlorobenzyl)-1,2,3,4-tetrahydro-7-methoxy-1-methylene-.beta.-carboline
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 338.118590939 u
Formula C20H19ClN2O
InChI InChI=1S/C20H19ClN2O/c1-13-20-17(16-8-7-15(24-2)11-19(16)22-20)9-10-23(13)12-14-5-3-4-6-18(14)21/h3-8,11,22H,1,9-10,12H2,2H3
InChIKey CENJYJPCBVUWPJ-UHFFFAOYSA-N
Molecular Weight 338.838 g/mol
SMILES C1=2NC=3C=C(OC)C=CC3C2CCN(C1=C)CC=1C(Cl)=CC=CC1