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ethanediamide, N~1~-[(3-fluorophenyl)methyl]-N~2~-(1H-indol-5-yl)-

View entire compound with spectra: 2 NMR

ethanediamide, N~1~-[(3-fluorophenyl)methyl]-N~2~-(1H-indol-5-yl)-
SpectraBase Compound ID 4lyDk7BGWub
InChI InChI=1S/C17H14FN3O2/c18-13-3-1-2-11(8-13)10-20-16(22)17(23)21-14-4-5-15-12(9-14)6-7-19-15/h1-9,19H,10H2,(H,20,22)(H,21,23)
InChIKey MFMDNRFFYWUPNG-UHFFFAOYSA-N
Mol Weight 311.32 g/mol
Molecular Formula C17H14FN3O2
Exact Mass 311.107005 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID CthtcxspWil
Name Ethanediamide, N~1~-[(3-fluorophenyl)methyl]-N~2~-(1H-indol-5-yl)-
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 311.107004864 u
Formula C17H14FN3O2
InChI InChI=1S/C17H14FN3O2/c18-13-3-1-2-11(8-13)10-20-16(22)17(23)21-14-4-5-15-12(9-14)6-7-19-15/h1-9,19H,10H2,(H,20,22)(H,21,23)
InChIKey MFMDNRFFYWUPNG-UHFFFAOYSA-N
Molecular Weight 311.316 g/mol
SMILES N(C(C(NC=1C=CC=2NC=CC2C1)=O)=O)CC1=CC(F)=CC=C1