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3-Dimethylamino-3-phenylpropionic acid, (-)menthyl ester

View entire compound with spectra: 1 NMR

3-Dimethylamino-3-phenylpropionic acid, (-)menthyl ester
SpectraBase Compound ID Aey2FBbBKf8
InChI InChI=1S/C21H33NO2/c1-15(2)18-12-11-16(3)13-20(18)24-21(23)14-19(22(4)5)17-9-7-6-8-10-17/h6-10,15-16,18-20H,11-14H2,1-5H3
InChIKey VEEDFVLNPMMWQB-UHFFFAOYSA-N
Mol Weight 331.5 g/mol
Molecular Formula C21H33NO2
Exact Mass 331.251129 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 7V6iyA3tZRf
Name 3-Dimethylamino-3-phenylpropionic acid, (-)menthyl ester
Comments Computed using HOSE algorithm
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Exact Mass 331.251129305 u
Formula C21H33NO2
InChI InChI=1S/C21H33NO2/c1-15(2)18-12-11-16(3)13-20(18)24-21(23)14-19(22(4)5)17-9-7-6-8-10-17/h6-10,15-16,18-20H,11-14H2,1-5H3
InChIKey VEEDFVLNPMMWQB-UHFFFAOYSA-N
Molecular Weight 331.500 g/mol
SMILES C1(=CC=CC=C1)C(N(C)C)CC(OC1CC(CCC1C(C)C)C)=O