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Ethyl-N-(4-nitrobenzyloxycarbonyl)-glycylglycine

View entire compound with spectra: 5 NMR

Ethyl-N-(4-nitrobenzyloxycarbonyl)-glycylglycine
SpectraBase Compound ID CIPiVJpCkMK
InChI InChI=1S/C14H17N3O7/c1-2-23-13(19)8-15-12(18)7-16-14(20)24-9-10-3-5-11(6-4-10)17(21)22/h3-6H,2,7-9H2,1H3,(H,15,18)(H,16,20)
InChIKey JELBSBXCKDUPMS-UHFFFAOYSA-N
Mol Weight 339.3 g/mol
Molecular Formula C14H17N3O7
Exact Mass 339.10665 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID GBK82HPw3WT
Name Ethyl-N-(4-nitrobenzyloxycarbonyl)-glycylglycine
Comments Computed using HOSE algorithm
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Exact Mass 339.106649892 u
Formula C14H17N3O7
InChI InChI=1S/C14H17N3O7/c1-2-23-13(19)8-15-12(18)7-16-14(20)24-9-10-3-5-11(6-4-10)17(21)22/h3-6H,2,7-9H2,1H3,(H,15,18)(H,16,20)
InChIKey JELBSBXCKDUPMS-UHFFFAOYSA-N
Molecular Weight 339.304 g/mol
SMILES C1(N(=O)=O)=CC=C(C=C1)COC(NCC(NCC(=O)OCC)=O)=O