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L-Proline, N-(2-fluorobenzoyl)-, heptyl ester
SpectraBase Compound ID 4LFoFuMXvZT
InChI InChI=1S/C19H26FNO3/c1-2-3-4-5-8-14-24-19(23)17-12-9-13-21(17)18(22)15-10-6-7-11-16(15)20/h6-7,10-11,17H,2-5,8-9,12-14H2,1H3
InChIKey APXVBDYGCBYAGO-UHFFFAOYSA-N
Mol Weight 335.42 g/mol
Molecular Formula C19H26FNO3
Exact Mass 335.189672 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID OWlxkKEvoB
Name L-Proline, N-(2-fluorobenzoyl)-, heptyl ester
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 335.189671861 u
Formula C19H26FNO3
InChI InChI=1S/C19H26FNO3/c1-2-3-4-5-8-14-24-19(23)17-12-9-13-21(17)18(22)15-10-6-7-11-16(15)20/h6-7,10-11,17H,2-5,8-9,12-14H2,1H3
InChIKey APXVBDYGCBYAGO-UHFFFAOYSA-N
Molecular Weight 335.419 g/mol
SMILES C1(CCCN1C(=O)C1=C(C=CC=C1)F)C(=O)OCCCCCCC