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tert-Butyl (2S,3S)-3-amino-2-benzyl-3-cyclohexylpropanoate
SpectraBase Compound ID HuIIu7ovVxh
InChI InChI=1S/C20H31NO2/c1-20(2,3)23-19(22)17(14-15-10-6-4-7-11-15)18(21)16-12-8-5-9-13-16/h4,6-7,10-11,16-18H,5,8-9,12-14,21H2,1-3H3/t17-,18-/m0/s1
InChIKey LLEPDTBXLCCTGP-ROUUACIJSA-N
Mol Weight 317.47 g/mol
Molecular Formula C20H31NO2
Exact Mass 317.235479 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BfnFVS8miFW
Name tert-Butyl (2S,3S)-3-amino-2-benzyl-3-cyclohexylpropanoate
Alternate Name(s) (2S,3S)-3-amino-3-cyclohexyl-2-(phenylmethyl)propanoic acid tert-butyl ester tert-Butyl (2S,3S)-3-amino-2-benzyl-3-cyclohexyl-propanoate tert-Butyl (2S,3S)-3-azanyl-3-cyclohexyl-2-(phenylmethyl)propanoate
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Formula C20H31NO2
InChI InChI=1S/C20H31NO2/c1-20(2,3)23-19(22)17(14-15-10-6-4-7-11-15)18(21)16-12-8-5-9-13-16/h4,6-7,10-11,16-18H,5,8-9,12-14,21H2,1-3H3/t17-,18-/m0/s1
InChIKey LLEPDTBXLCCTGP-ROUUACIJSA-N
Molecular Weight 317.473 g/mol
SMILES N[C@]([C@@](C(OC(C)(C)C)=O)(Cc1ccccc1)[H])(C1CCCCC1)[H]
SPLASH splash10-03fr-3910000000-e55c5c3a51f84490eafa
Source of Spectrum SO-0-1325-4
Wiley ID 1545347