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veratric acid, 4-[ethyl(p-methoxy-alpha-methylphenethyl)amino]butyl ester, hydrochloride
SpectraBase Compound ID KwQVmWrgxc8
InChI InChI=1S/C25H35NO5.ClH/c1-6-26(19(2)17-20-9-12-22(28-3)13-10-20)15-7-8-16-31-25(27)21-11-14-23(29-4)24(18-21)30-5;/h9-14,18-19H,6-8,15-17H2,1-5H3;1H
InChIKey PLGQWYOULXPJRE-UHFFFAOYSA-N
Mol Weight 466.02 g/mol
Molecular Formula C25H36ClNO5
Exact Mass 465.228201 g/mol

1H Nuclear Magnetic Resonance (NMR) Chemical Shifts

1H Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID HUBhRfWHnAt
Name veratric acid, 4-[ethyl(p-methoxy-alpha-methylphenethyl)amino]butyl ester, hydrochloride
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Formula C25H36ClNO5
InChI InChI=1S/C25H35NO5.ClH/c1-6-26(19(2)17-20-9-12-22(28-3)13-10-20)15-7-8-16-31-25(27)21-11-14-23(29-4)24(18-21)30-5;/h9-14,18-19H,6-8,15-17H2,1-5H3;1H
InChIKey PLGQWYOULXPJRE-UHFFFAOYSA-N
Instrument Name Varian CFT-20
Sadtler NMR Number 27388M
Solvent CDCl3