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3-(1,3-dioxohexahydro-1H-4,7-methanoisoindol-2(3H)-yl)-N-(4-fluorophenyl)propanamide

View entire compound with spectra: 2 NMR

3-(1,3-dioxohexahydro-1H-4,7-methanoisoindol-2(3H)-yl)-N-(4-fluorophenyl)propanamide
SpectraBase Compound ID Db7pC4m7h1R
InChI InChI=1S/C18H19FN2O3/c19-12-3-5-13(6-4-12)20-14(22)7-8-21-17(23)15-10-1-2-11(9-10)16(15)18(21)24/h3-6,10-11,15-16H,1-2,7-9H2,(H,20,22)
InChIKey JOVUNFDAJBFQME-UHFFFAOYSA-N
Mol Weight 330.36 g/mol
Molecular Formula C18H19FN2O3
Exact Mass 330.137971 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID LrODcdmiqTg
Name 3-(1,3-Dioxohexahydro-1H-4,7-methanoisoindol-2(3H)-yl)-N-(4-fluorophenyl)propanamide
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 330.137970640 u
Formula C18H19FN2O3
InChI InChI=1S/C18H19FN2O3/c19-12-3-5-13(6-4-12)20-14(22)7-8-21-17(23)15-10-1-2-11(9-10)16(15)18(21)24/h3-6,10-11,15-16H,1-2,7-9H2,(H,20,22)
InChIKey JOVUNFDAJBFQME-UHFFFAOYSA-N
Molecular Weight 330.359 g/mol
SMILES N(C(CCN1C(C2C3CCC(C2C1=O)C3)=O)=O)C1=CC=C(C=C1)F