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2-Naphthalenecarboxamide, N-[2-([1,1'-biphenyl]-2-yloxy)-5-(trifluoromethyl)phenyl]-1-methoxy-
SpectraBase Compound ID IxHv2S6RpFe
InChI InChI=1S/C31H22F3NO3/c1-37-29-24-13-6-5-11-21(24)15-17-25(29)30(36)35-26-19-22(31(32,33)34)16-18-28(26)38-27-14-8-7-12-23(27)20-9-3-2-4-10-20/h2-19H,1H3,(H,35,36)
InChIKey IORJZAUMEYYXEQ-UHFFFAOYSA-N
Mol Weight 513.52 g/mol
Molecular Formula C31H22F3NO3
Exact Mass 513.155178 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID BgKkiRz5tyG
Name 2-Naphthalenecarboxamide, N-[2-([1,1'-biphenyl]-2-yloxy)-5-(trifluoromethyl)phenyl]-1-methoxy-
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 513.155178058 u
Formula C31H22F3NO3
InChI InChI=1S/C31H22F3NO3/c1-37-29-24-13-6-5-11-21(24)15-17-25(29)30(36)35-26-19-22(31(32,33)34)16-18-28(26)38-27-14-8-7-12-23(27)20-9-3-2-4-10-20/h2-19H,1H3,(H,35,36)
InChIKey IORJZAUMEYYXEQ-UHFFFAOYSA-N
Molecular Weight 513.516 g/mol
SMILES C=1C=C2C(=C(C=CC2=CC1)C(NC=1C(=CC=C(C(F)(F)F)C1)OC1=CC=CC=C1C1=CC=CC=C1)=O)OC