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

View entire compound with spectra: 1 NMR

Isonipecotic acid, N-(2-methoxybenzoyl)-, nonyl ester
SpectraBase Compound ID KPgklwuI84d
InChI InChI=1S/C23H35NO4/c1-3-4-5-6-7-8-11-18-28-23(26)19-14-16-24(17-15-19)22(25)20-12-9-10-13-21(20)27-2/h9-10,12-13,19H,3-8,11,14-18H2,1-2H3
InChIKey YGSPLNSMMLCYNZ-UHFFFAOYSA-N
Mol Weight 389.5 g/mol
Molecular Formula C23H35NO4
Exact Mass 389.256609 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID EMjxjt2SAL1
Name Isonipecotic acid, N-(2-methoxybenzoyl)-, nonyl ester
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 389.256608607 u
Formula C23H35NO4
InChI InChI=1S/C23H35NO4/c1-3-4-5-6-7-8-11-18-28-23(26)19-14-16-24(17-15-19)22(25)20-12-9-10-13-21(20)27-2/h9-10,12-13,19H,3-8,11,14-18H2,1-2H3
InChIKey YGSPLNSMMLCYNZ-UHFFFAOYSA-N
Molecular Weight 389.536 g/mol
SMILES COC1=C(C=CC=C1)C(N1CCC(C(OCCCCCCCCC)=O)CC1)=O