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2-[4-(4-Fluorocinnamoyl)anilino]-3-piperidino-1,4-naphthoquinone

View entire compound with spectra: 1 NMR

2-[4-(4-Fluorocinnamoyl)anilino]-3-piperidino-1,4-naphthoquinone
SpectraBase Compound ID Ge0LZ0zubQi
InChI InChI=1S/C30H25FN2O3/c31-22-13-8-20(9-14-22)10-17-26(34)21-11-15-23(16-12-21)32-27-28(33-18-4-1-5-19-33)30(36)25-7-3-2-6-24(25)29(27)35/h2-3,6-17,32H,1,4-5,18-19H2/b17-10+
InChIKey SQIOYJIDLFRNNA-LICLKQGHSA-N
Mol Weight 480.54 g/mol
Molecular Formula C30H25FN2O3
Exact Mass 480.184921 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID EQss2JVCLON
Name 2-[4-(4-Fluorocinnamoyl)anilino]-3-piperidino-1,4-naphthoquinone
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 480.184920833 u
Formula C30H25FN2O3
InChI InChI=1S/C30H25FN2O3/c31-22-13-8-20(9-14-22)10-17-26(34)21-11-15-23(16-12-21)32-27-28(33-18-4-1-5-19-33)30(36)25-7-3-2-6-24(25)29(27)35/h2-3,6-17,32H,1,4-5,18-19H2/b17-10+
InChIKey SQIOYJIDLFRNNA-LICLKQGHSA-N
Molecular Weight 480.539 g/mol
SMILES C1=CC=C2C(=C1)C(C(=C(C2=O)NC1=CC=C(C=C1)C(\C=C\C1=CC=C(F)C=C1)=O)N1CCCCC1)=O