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.beta.-Alanine, N-(1-naphthoyl)-, decyl ester
SpectraBase Compound ID ClWoIkFu51r
InChI InChI=1S/C24H33NO3/c1-2-3-4-5-6-7-8-11-19-28-23(26)17-18-25-24(27)22-16-12-14-20-13-9-10-15-21(20)22/h9-10,12-16H,2-8,11,17-19H2,1H3,(H,25,27)
InChIKey JIEWLVMASXISDZ-UHFFFAOYSA-N
Mol Weight 383.5 g/mol
Molecular Formula C24H33NO3
Exact Mass 383.246044 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 9CEieKd5BfM
Name .beta.-Alanine, N-(1-naphthoyl)-, decyl ester
Comments Computed using HOSE algorithm
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Exact Mass 383.246043924 u
Formula C24H33NO3
InChI InChI=1S/C24H33NO3/c1-2-3-4-5-6-7-8-11-19-28-23(26)17-18-25-24(27)22-16-12-14-20-13-9-10-15-21(20)22/h9-10,12-16H,2-8,11,17-19H2,1H3,(H,25,27)
InChIKey JIEWLVMASXISDZ-UHFFFAOYSA-N
Molecular Weight 383.532 g/mol
SMILES C1=2C(=CC=CC2C(NCCC(OCCCCCCCCCC)=O)=O)C=CC=C1