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Glutaric acid, monoamide, N-(2-methoxybenzyl)-, isohexyl ester

View entire compound with spectra: 1 NMR

Glutaric acid, monoamide, N-(2-methoxybenzyl)-, isohexyl ester
SpectraBase Compound ID 7GFXMLKyiJD
InChI InChI=1S/C19H29NO4/c1-15(2)8-7-13-24-19(22)12-6-11-18(21)20-14-16-9-4-5-10-17(16)23-3/h4-5,9-10,15H,6-8,11-14H2,1-3H3,(H,20,21)
InChIKey CCBXKXIYCUHVAU-UHFFFAOYSA-N
Mol Weight 335.44 g/mol
Molecular Formula C19H29NO4
Exact Mass 335.209658 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID EiKux65MAHN
Name Glutaric acid, monoamide, N-(2-methoxybenzyl)-, isohexyl ester
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 335.209658414 u
Formula C19H29NO4
InChI InChI=1S/C19H29NO4/c1-15(2)8-7-13-24-19(22)12-6-11-18(21)20-14-16-9-4-5-10-17(16)23-3/h4-5,9-10,15H,6-8,11-14H2,1-3H3,(H,20,21)
InChIKey CCBXKXIYCUHVAU-UHFFFAOYSA-N
Molecular Weight 335.444 g/mol
SMILES COC1=C(C=CC=C1)CNC(CCCC(OCCCC(C)C)=O)=O