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1-Benzyl-2-(4-methoxyphenyl)-4,5,6,7-tetrahydroindole
SpectraBase Compound ID ATot4peAatT
InChI InChI=1S/C22H23NO/c1-24-20-13-11-18(12-14-20)22-15-19-9-5-6-10-21(19)23(22)16-17-7-3-2-4-8-17/h2-4,7-8,11-15H,5-6,9-10,16H2,1H3
InChIKey BWPDZQXJMXNZDX-UHFFFAOYSA-N
Mol Weight 317.43 g/mol
Molecular Formula C22H23NO
Exact Mass 317.177964 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID LKUY4iZZH4B
Name 1-Benzyl-2-(4-methoxyphenyl)-4,5,6,7-tetrahydroindole
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 317.177964364 u
Formula C22H23NO
InChI InChI=1S/C22H23NO/c1-24-20-13-11-18(12-14-20)22-15-19-9-5-6-10-21(19)23(22)16-17-7-3-2-4-8-17/h2-4,7-8,11-15H,5-6,9-10,16H2,1H3
InChIKey BWPDZQXJMXNZDX-UHFFFAOYSA-N
Molecular Weight 317.432 g/mol
SMILES C1=2CCCCC2C=C(N1CC1=CC=CC=C1)C1=CC=C(C=C1)OC