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Butanoic acid, 2-methyl-3-[[(phenylmethoxy)carbonyl]amino]-, methyl ester, (R*,R*)-(.+-.)-
SpectraBase Compound ID 7IKn06SVprS
InChI InChI=1S/C14H19NO4/c1-10(13(16)18-3)11(2)15-14(17)19-9-12-7-5-4-6-8-12/h4-8,10-11H,9H2,1-3H3,(H,15,17)/t10-,11-/m1/s1
InChIKey IPKMDDROPILTAT-GHMZBOCLSA-N
Mol Weight 265.31 g/mol
Molecular Formula C14H19NO4
Exact Mass 265.131408 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID I9BboW5sKBR
Name Butanoic acid, 2-methyl-3-[[(phenylmethoxy)carbonyl]amino]-, methyl ester, (R*,R*)-(.+-.)-
Comments Computed using HOSE algorithm
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Exact Mass 265.131408092 u
Formula C14H19NO4
InChI InChI=1S/C14H19NO4/c1-10(13(16)18-3)11(2)15-14(17)19-9-12-7-5-4-6-8-12/h4-8,10-11H,9H2,1-3H3,(H,15,17)/t10-,11-/m1/s1
InChIKey IPKMDDROPILTAT-GHMZBOCLSA-N
Molecular Weight 265.309 g/mol
SMILES [C@@](C(=O)OC)([C@](NC(=O)OCC=1C=CC=CC1)(C)[H])(C)[H]