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(E)-(Z)-2,3-Dihydro-1,3,3-trimethyl-2-[(2-phenyl-3-nitro)propylidene]-1H-indole
SpectraBase Compound ID 3JYTDIszaCb
InChI InChI=1S/C20H22N2O2/c1-20(2)17-11-7-8-12-18(17)21(3)19(20)13-16(14-22(23)24)15-9-5-4-6-10-15/h4-13,16H,14H2,1-3H3/b19-13+
InChIKey IAMOYGICFQUXAN-CPNJWEJPSA-N
Mol Weight 322.41 g/mol
Molecular Formula C20H22N2O2
Exact Mass 322.168128 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Fq4Y3efEeFR
Name (E)-(Z)-2,3-Dihydro-1,3,3-trimethyl-2-[(2-phenyl-3-nitro)propylidene]-1H-indole
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 322.168127954 u
Formula C20H22N2O2
InChI InChI=1S/C20H22N2O2/c1-20(2)17-11-7-8-12-18(17)21(3)19(20)13-16(14-22(23)24)15-9-5-4-6-10-15/h4-13,16H,14H2,1-3H3/b19-13+
InChIKey IAMOYGICFQUXAN-CPNJWEJPSA-N
Molecular Weight 322.408 g/mol
SMILES C=12N(\C(C(C1C=CC=C2)(C)C)=C/C(CN(=O)=O)C1=CC=CC=C1)C