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(4-nitrophenyl) 2-(4-benzyloxy-1H-indol-3-yl)acetate

View entire compound with spectra: 1 NMR, and 2 MS (GC)

(4-nitrophenyl) 2-(4-benzyloxy-1H-indol-3-yl)acetate
SpectraBase Compound ID 3lJAtmNOC8V
InChI InChI=1S/C23H18N2O5/c26-22(30-19-11-9-18(10-12-19)25(27)28)13-17-14-24-20-7-4-8-21(23(17)20)29-15-16-5-2-1-3-6-16/h1-12,14,24H,13,15H2
InChIKey MZIDEGZMUSNNNW-UHFFFAOYSA-N
Mol Weight 402.41 g/mol
Molecular Formula C23H18N2O5
Exact Mass 402.121572 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID GrNfv0mY8bC
Name (4-Nitrophenyl) 2-(4-benzyloxy-1H-indol-3-yl)acetate
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 402.121571683 u
Formula C23H18N2O5
InChI InChI=1S/C23H18N2O5/c26-22(30-19-11-9-18(10-12-19)25(27)28)13-17-14-24-20-7-4-8-21(23(17)20)29-15-16-5-2-1-3-6-16/h1-12,14,24H,13,15H2
InChIKey MZIDEGZMUSNNNW-UHFFFAOYSA-N
Molecular Weight 402.406 g/mol
SMILES C=1(C2=C(C=CC=C2OCC2=CC=CC=C2)NC1)CC(OC1=CC=C(N(=O)=O)C=C1)=O