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N-cbz-Glycylglycine p-nitrophenyl ester

View entire compound with spectra: 1 NMR

N-cbz-Glycylglycine p-nitrophenyl ester
SpectraBase Compound ID BLXlIWMYmTE
InChI InChI=1S/C18H17N3O7/c22-16(10-20-18(24)27-12-13-4-2-1-3-5-13)19-11-17(23)28-15-8-6-14(7-9-15)21(25)26/h1-9H,10-12H2,(H,19,22)(H,20,24)
InChIKey VJPZTTLCVFONEM-UHFFFAOYSA-N
Mol Weight 387.35 g/mol
Molecular Formula C18H17N3O7
Exact Mass 387.10665 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 20su4rxGlDM
Name N-cbz-Glycylglycine p-nitrophenyl ester
Comments Computed using HOSE algorithm
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Exact Mass 387.106649892 u
Formula C18H17N3O7
InChI InChI=1S/C18H17N3O7/c22-16(10-20-18(24)27-12-13-4-2-1-3-5-13)19-11-17(23)28-15-8-6-14(7-9-15)21(25)26/h1-9H,10-12H2,(H,19,22)(H,20,24)
InChIKey VJPZTTLCVFONEM-UHFFFAOYSA-N
Molecular Weight 387.348 g/mol
SMILES C1=C(C=CC=C1)COC(NCC(NCC(OC1=CC=C(C=C1)N(=O)=O)=O)=O)=O