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2-[(Benzyloxy)methyl]-1-methyl-5-nitro-3-phenyl-1H-indole
SpectraBase Compound ID Dz6mKdGCGh6
InChI InChI=1S/C23H20N2O3/c1-24-21-13-12-19(25(26)27)14-20(21)23(18-10-6-3-7-11-18)22(24)16-28-15-17-8-4-2-5-9-17/h2-14H,15-16H2,1H3
InChIKey IHTHTJNSUCSDLQ-UHFFFAOYSA-N
Mol Weight 372.42 g/mol
Molecular Formula C23H20N2O3
Exact Mass 372.147393 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID VFK0xmyGma
Name 2-[(Benzyloxy)methyl]-1-methyl-5-nitro-3-phenyl-1H-indole
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 372.147392509 u
Formula C23H20N2O3
InChI InChI=1S/C23H20N2O3/c1-24-21-13-12-19(25(26)27)14-20(21)23(18-10-6-3-7-11-18)22(24)16-28-15-17-8-4-2-5-9-17/h2-14H,15-16H2,1H3
InChIKey IHTHTJNSUCSDLQ-UHFFFAOYSA-N
Molecular Weight 372.424 g/mol
SMILES C=1(N(C2=C(C1C1=CC=CC=C1)C=C(C=C2)N(=O)=O)C)COCC1=CC=CC=C1