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2-(benzyloxycarbonylamino)-3-(1-nitrocyclohexyl)propionic acid methyl ester
SpectraBase Compound ID BoQnhy5rSMA
InChI InChI=1S/C18H24N2O6/c1-25-16(21)15(12-18(20(23)24)10-6-3-7-11-18)19-17(22)26-13-14-8-4-2-5-9-14/h2,4-5,8-9,15H,3,6-7,10-13H2,1H3,(H,19,22)/t15-/m0/s1
InChIKey OXEOMLUMCRRYIX-HNNXBMFYSA-N
Mol Weight 364.4 g/mol
Molecular Formula C18H24N2O6
Exact Mass 364.163436 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DPeOsI6ozqL
Name 2-(benzyloxycarbonylamino)-3-(1-nitrocyclohexyl)propionic acid methyl ester
Alternate Name(s) 3-(1-nitrocyclohexyl)-2-(phenylmethoxycarbonylamino)propanoic acid methyl ester Methyl 3-(1-nitrocyclohexyl)-2-(phenylmethoxycarbonylamino)propanoate
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Formula C18H24N2O6
InChI InChI=1S/C18H24N2O6/c1-25-16(21)15(12-18(20(23)24)10-6-3-7-11-18)19-17(22)26-13-14-8-4-2-5-9-14/h2,4-5,8-9,15H,3,6-7,10-13H2,1H3,(H,19,22)/t15-/m0/s1
InChIKey OXEOMLUMCRRYIX-HNNXBMFYSA-N
Molecular Weight 364.398 g/mol
SMILES N(C(=O)OCc1ccccc1)[C@@](CC1(N(=O)=O)CCCCC1)(C(=O)OC)[H]
SPLASH splash10-0a4i-0901000000-65fc6b86ca22ea319662
Source of Spectrum KC-0-1120-19
Wiley ID 824663