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L-Valine, N-(2-methoxybenzoyl)-, dodecyl ester

View entire compound with spectra: 1 NMR

L-Valine, N-(2-methoxybenzoyl)-, dodecyl ester
SpectraBase Compound ID 8DRVaNich0L
InChI InChI=1S/C25H41NO4/c1-5-6-7-8-9-10-11-12-13-16-19-30-25(28)23(20(2)3)26-24(27)21-17-14-15-18-22(21)29-4/h14-15,17-18,20,23H,5-13,16,19H2,1-4H3,(H,26,27)
InChIKey YNDKIERMGKYAGX-UHFFFAOYSA-N
Mol Weight 419.6 g/mol
Molecular Formula C25H41NO4
Exact Mass 419.303559 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID HEo6mdaNPu4
Name L-Valine, N-(2-methoxybenzoyl)-, dodecyl ester
Comments Computed using HOSE algorithm
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Exact Mass 419.303558800 u
Formula C25H41NO4
InChI InChI=1S/C25H41NO4/c1-5-6-7-8-9-10-11-12-13-16-19-30-25(28)23(20(2)3)26-24(27)21-17-14-15-18-22(21)29-4/h14-15,17-18,20,23H,5-13,16,19H2,1-4H3,(H,26,27)
InChIKey YNDKIERMGKYAGX-UHFFFAOYSA-N
Molecular Weight 419.606 g/mol
SMILES C1=CC=CC(=C1OC)C(NC(C(C)C)C(=O)OCCCCCCCCCCCC)=O