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Methyl 2-methyl-3-{(benzyloxycarbonyl)amino]-2-(prop-2'-enyl)-4-phenylbutanoate
SpectraBase Compound ID 2YyanGfqqf8
InChI InChI=1S/C23H27NO4/c1-4-15-23(2,21(25)27-3)20(16-18-11-7-5-8-12-18)24-22(26)28-17-19-13-9-6-10-14-19/h4-14,20H,1,15-17H2,2-3H3,(H,24,26)
InChIKey SRDDIOYARQQOLW-UHFFFAOYSA-N
Mol Weight 381.47 g/mol
Molecular Formula C23H27NO4
Exact Mass 381.194008 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID ALE9WZqFMej
Name Methyl 2-methyl-3-{(benzyloxycarbonyl)amino]-2-(prop-2'-enyl)-4-phenylbutanoate
Comments Computed using HOSE algorithm
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Exact Mass 381.194008349 u
Formula C23H27NO4
InChI InChI=1S/C23H27NO4/c1-4-15-23(2,21(25)27-3)20(16-18-11-7-5-8-12-18)24-22(26)28-17-19-13-9-6-10-14-19/h4-14,20H,1,15-17H2,2-3H3,(H,24,26)
InChIKey SRDDIOYARQQOLW-UHFFFAOYSA-N
Molecular Weight 381.472 g/mol
SMILES C(C(NC(=O)OCC1=CC=CC=C1)CC1=CC=CC=C1)(C(=O)OC)(CC=C)C