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cis-1-[N-(Benzyloxycarbonyl)-(1S)-1-amino-3-cyano-(Z)-2-propene]-4-methyl-2,6,7-trioxabicyclo[2.2.2]octane [Cbz-L-cis-Gly(-CH=CH-CN)-OBO ester]
SpectraBase Compound ID LXXTplvrfy3
InChI InChI=1S/C18H20N2O5/c1-17-11-23-18(24-12-17,25-13-17)15(8-5-9-19)20-16(21)22-10-14-6-3-2-4-7-14/h2-8,15H,10-13H2,1H3,(H,20,21)/b8-5-
InChIKey LOARJAUAYAGYSJ-YVMONPNESA-N
Mol Weight 344.37 g/mol
Molecular Formula C18H20N2O5
Exact Mass 344.137222 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID ENTLFo0V5ko
Name cis-1-[N-(Benzyloxycarbonyl)-(1S)-1-amino-3-cyano-(Z)-2-propene]-4-methyl-2,6,7-trioxabicyclo[2.2.2]octane [Cbz-L-cis-Gly(-CH=CH-CN)-OBO ester]
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Formula C18H20N2O5
InChI InChI=1S/C18H20N2O5/c1-17-11-23-18(24-12-17,25-13-17)15(8-5-9-19)20-16(21)22-10-14-6-3-2-4-7-14/h2-8,15H,10-13H2,1H3,(H,20,21)/b8-5-
InChIKey LOARJAUAYAGYSJ-YVMONPNESA-N
Molecular Weight 344.367 g/mol
SMILES N(C(=O)OCc1ccccc1)C(C12OCC(CO2)(C)CO1)\C=C/C#N
SPLASH splash10-00dl-0095000000-11868a9664d2aa9350b5
Source of Spectrum KC-57-1505-9
Wiley ID 1622970