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dl-Alanine, N-methyl-N-(2-benzyloxyethoxycarbonyl)-, 2-benzyloxyethyl ester
SpectraBase Compound ID FPHQpM02UnX
InChI InChI=1S/C23H29NO6/c1-19(22(25)29-15-13-27-17-20-9-5-3-6-10-20)24(2)23(26)30-16-14-28-18-21-11-7-4-8-12-21/h3-12,19H,13-18H2,1-2H3
InChIKey DIAMMBHSEGNBBB-UHFFFAOYSA-N
Mol Weight 415.49 g/mol
Molecular Formula C23H29NO6
Exact Mass 415.199488 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 9TwR3bq1bDL
Name dl-Alanine, N-methyl-N-(2-benzyloxyethoxycarbonyl)-, 2-benzyloxyethyl ester
Comments Computed using HOSE algorithm
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Exact Mass 415.199487652 u
Formula C23H29NO6
InChI InChI=1S/C23H29NO6/c1-19(22(25)29-15-13-27-17-20-9-5-3-6-10-20)24(2)23(26)30-16-14-28-18-21-11-7-4-8-12-21/h3-12,19H,13-18H2,1-2H3
InChIKey DIAMMBHSEGNBBB-UHFFFAOYSA-N
Molecular Weight 415.486 g/mol
SMILES CC(N(C)C(=O)OCCOCC1=CC=CC=C1)C(=O)OCCOCC1=CC=CC=C1