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N(e)-(2-Cyanoacetyl)-N(a)-tert-butyloxycarbonyllysine methyl ester
SpectraBase Compound ID 83UJe1oM0BW
InChI InChI=1S/C15H25N3O5/c1-15(2,3)23-14(21)18-11(13(20)22-4)7-5-6-10-17-12(19)8-9-16/h11H,5-8,10H2,1-4H3,(H,17,19)(H,18,21)
InChIKey ALFUOFSWCASBBH-UHFFFAOYSA-N
Mol Weight 327.38 g/mol
Molecular Formula C15H25N3O5
Exact Mass 327.179421 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Gg4opAwR2vs
Name N(e)-(2-Cyanoacetyl)-N(a)-tert-butyloxycarbonyllysine methyl ester
Alternate Name(s) 6-[(2-cyano-1-oxoethyl)amino]-2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]hexanoic acid methyl ester Methyl 6-[(2-cyanoacetyl)amino]-2-[(2-methylpropan-2-yl)oxycarbonylamino]hexanoate Methyl 2-(tert-butoxycarbonylamino)-6-[(2-cyanoacetyl)amino]hexanoate Methyl 6-(2-cyanoethanoylamino)-2-[(2-methylpropan-2-yl)oxycarbonylamino]hexanoate
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Formula C15H25N3O5
InChI InChI=1S/C15H25N3O5/c1-15(2,3)23-14(21)18-11(13(20)22-4)7-5-6-10-17-12(19)8-9-16/h11H,5-8,10H2,1-4H3,(H,17,19)(H,18,21)
InChIKey ALFUOFSWCASBBH-UHFFFAOYSA-N
Molecular Weight 327.381 g/mol
SMILES N(C(OC(C)(C)C)=O)C(CCCCNC(CC#N)=O)C(=O)OC
SPLASH splash10-0udi-0910000000-a6bfaf0d73e3080dc5c2
Source of Spectrum U1-2002-4068-20
Wiley ID 1523593