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Isonipecotic acid, N-(2-methoxybenzoyl)-, decyl ester

View entire compound with spectra: 1 NMR

Isonipecotic acid, N-(2-methoxybenzoyl)-, decyl ester
SpectraBase Compound ID gpqyv20MWE
InChI InChI=1S/C24H37NO4/c1-3-4-5-6-7-8-9-12-19-29-24(27)20-15-17-25(18-16-20)23(26)21-13-10-11-14-22(21)28-2/h10-11,13-14,20H,3-9,12,15-19H2,1-2H3
InChIKey NSYZMNCZBSBGSN-UHFFFAOYSA-N
Mol Weight 403.6 g/mol
Molecular Formula C24H37NO4
Exact Mass 403.272259 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID JL6GIYTZJCp
Name Isonipecotic acid, N-(2-methoxybenzoyl)-, decyl ester
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 403.272258671 u
Formula C24H37NO4
InChI InChI=1S/C24H37NO4/c1-3-4-5-6-7-8-9-12-19-29-24(27)20-15-17-25(18-16-20)23(26)21-13-10-11-14-22(21)28-2/h10-11,13-14,20H,3-9,12,15-19H2,1-2H3
InChIKey NSYZMNCZBSBGSN-UHFFFAOYSA-N
Molecular Weight 403.563 g/mol
SMILES COC1=C(C=CC=C1)C(N1CCC(C(OCCCCCCCCCC)=O)CC1)=O