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(-)-p-aminocinnamic acid, 2-methylbutyl ester
SpectraBase Compound ID 6pADaz2Du5A
InChI InChI=1S/C14H19NO2/c1-3-11(2)10-17-14(16)9-6-12-4-7-13(15)8-5-12/h4-9,11H,3,10,15H2,1-2H3
InChIKey OUZTVIGSXSIPAZ-UHFFFAOYSA-N
Mol Weight 233.31 g/mol
Molecular Formula C14H19NO2
Exact Mass 233.141579 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 3ueoQbDWm8K
Name (-)-p-aminocinnamic acid, 2-methylbutyl ester
Comments Computed using HOSE algorithm
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Exact Mass 233.141578854 u
Formula C14H19NO2
InChI InChI=1S/C14H19NO2/c1-3-11(2)10-17-14(16)9-6-12-4-7-13(15)8-5-12/h4-9,11H,3,10,15H2,1-2H3
InChIKey OUZTVIGSXSIPAZ-UHFFFAOYSA-N
Molecular Weight 233.311 g/mol
SMILES NC=1C=CC(=CC1)C=CC(OCC(CC)C)=O