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Dimethyl 2-(benzyloxycarbonylamino)-4-hydroxypentane-1,5-dioate

View entire compound with spectra: 1 NMR, 1 FTIR, and 1 MS (GC)

Dimethyl 2-(benzyloxycarbonylamino)-4-hydroxypentane-1,5-dioate
SpectraBase Compound ID LpPqqJER00D
InChI InChI=1S/C15H19NO7/c1-21-13(18)11(8-12(17)14(19)22-2)16-15(20)23-9-10-6-4-3-5-7-10/h3-7,11-12,17H,8-9H2,1-2H3,(H,16,20)
InChIKey WKGTXWFVXZEFBE-UHFFFAOYSA-N
Mol Weight 325.32 g/mol
Molecular Formula C15H19NO7
Exact Mass 325.116152 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 8HuIFpbcWYS
Name Dimethyl 2-(benzyloxycarbonylamino)-4-hydroxypentane-1,5-dioate
Comments Computed using HOSE algorithm
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Exact Mass 325.116151949 u
Formula C15H19NO7
InChI InChI=1S/C15H19NO7/c1-21-13(18)11(8-12(17)14(19)22-2)16-15(20)23-9-10-6-4-3-5-7-10/h3-7,11-12,17H,8-9H2,1-2H3,(H,16,20)
InChIKey WKGTXWFVXZEFBE-UHFFFAOYSA-N
Molecular Weight 325.317 g/mol
SMILES C(NC(CC(C(=O)OC)O)C(=O)OC)(=O)OCC1=CC=CC=C1