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(3R)-3-(tert-butoxycarbonylamino)-4-(3-ketocyclohexyl)butyric acid methyl ester
SpectraBase Compound ID 1xrbmFMO9xg
InChI InChI=1S/C16H27NO5/c1-16(2,3)22-15(20)17-12(10-14(19)21-4)8-11-6-5-7-13(18)9-11/h11-12H,5-10H2,1-4H3,(H,17,20)/t11?,12-/m1/s1
InChIKey KNBYGQNVKBINFM-PIJUOVFKSA-N
Mol Weight 313.39 g/mol
Molecular Formula C16H27NO5
Exact Mass 313.188923 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LcWtnPmXTK3
Name (3R)-3-(tert-butoxycarbonylamino)-4-(3-ketocyclohexyl)butyric acid methyl ester
Alternate Name(s) (3R)-3-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-4-(3-oxocyclohexyl)butanoic acid methyl ester Methyl (3R)-3-[(2-methylpropan-2-yl)oxycarbonylamino]-4-(3-oxidanylidenecyclohexyl)butanoate Methyl (3R)-3-[(2-methylpropan-2-yl)oxycarbonylamino]-4-(3-oxocyclohexyl)butanoate
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Formula C16H27NO5
InChI InChI=1S/C16H27NO5/c1-16(2,3)22-15(20)17-12(10-14(19)21-4)8-11-6-5-7-13(18)9-11/h11-12H,5-10H2,1-4H3,(H,17,20)/t11?,12-/m1/s1
InChIKey KNBYGQNVKBINFM-PIJUOVFKSA-N
Molecular Weight 313.394 g/mol
SMILES N(C(OC(C)(C)C)=O)[C@@](CC(=O)OC)(CC1CC(=O)CCC1)[H]
SPLASH splash10-0a4i-9810000000-031d61036478b674e8d4
Source of Spectrum J-64-7585-26
Wiley ID 1531174