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Methyl 3-tert-butyloxycarbonylamino-3-(2,4,6-trimethylphenyl)propanoate
SpectraBase Compound ID KHysZI7yjRO
InChI InChI=1S/C18H27NO4/c1-11-8-12(2)16(13(3)9-11)14(10-15(20)22-7)19-17(21)23-18(4,5)6/h8-9,14H,10H2,1-7H3,(H,19,21)/t14-/m0/s1
InChIKey WTFUNWANIPCHPO-AWEZNQCLSA-N
Mol Weight 321.42 g/mol
Molecular Formula C18H27NO4
Exact Mass 321.194008 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID CmTPnfHlTx0
Name Methyl 3-tert-butyloxycarbonylamino-3-(2,4,6-trimethylphenyl)propanoate
Comments Computed using HOSE algorithm
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Exact Mass 321.194008349 u
Formula C18H27NO4
InChI InChI=1S/C18H27NO4/c1-11-8-12(2)16(13(3)9-11)14(10-15(20)22-7)19-17(21)23-18(4,5)6/h8-9,14H,10H2,1-7H3,(H,19,21)/t14-/m0/s1
InChIKey WTFUNWANIPCHPO-AWEZNQCLSA-N
Molecular Weight 321.417 g/mol
SMILES [C@](C1=C(C=C(C=C1C)C)C)(CC(=O)OC)(NC(OC(C)(C)C)=O)[H]