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

View entire compound with spectra: 1 NMR

L-Valine, N-(2-methoxybenzoyl)-, nonyl ester
SpectraBase Compound ID JhRxsxjcnlk
InChI InChI=1S/C22H35NO4/c1-5-6-7-8-9-10-13-16-27-22(25)20(17(2)3)23-21(24)18-14-11-12-15-19(18)26-4/h11-12,14-15,17,20H,5-10,13,16H2,1-4H3,(H,23,24)
InChIKey WVCPPOWOQBXIKD-UHFFFAOYSA-N
Mol Weight 377.5 g/mol
Molecular Formula C22H35NO4
Exact Mass 377.256609 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Dc2O39NI5fU
Name L-Valine, N-(2-methoxybenzoyl)-, nonyl ester
Comments Computed using HOSE algorithm
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Exact Mass 377.256608607 u
Formula C22H35NO4
InChI InChI=1S/C22H35NO4/c1-5-6-7-8-9-10-13-16-27-22(25)20(17(2)3)23-21(24)18-14-11-12-15-19(18)26-4/h11-12,14-15,17,20H,5-10,13,16H2,1-4H3,(H,23,24)
InChIKey WVCPPOWOQBXIKD-UHFFFAOYSA-N
Molecular Weight 377.525 g/mol
SMILES C1(=C(C=CC=C1)C(NC(C(C)C)C(=O)OCCCCCCCCC)=O)OC