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N-Phenylazo-2-(N'-benzyloxycarbonylprolyloxymethyl)pyrrolidine
SpectraBase Compound ID 57U7MJSnLtd
InChI InChI=1S/C24H28N4O4/c29-23(22-14-8-15-27(22)24(30)32-17-19-9-3-1-4-10-19)31-18-21-13-7-16-28(21)26-25-20-11-5-2-6-12-20/h1-6,9-12,21-22H,7-8,13-18H2/b26-25+
InChIKey OCLCAAVPIUIJNE-OCEACIFDSA-N
Mol Weight 436.51 g/mol
Molecular Formula C24H28N4O4
Exact Mass 436.211055 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID FPFLvkPQJy2
Name N-Phenylazo-2-(N'-benzyloxycarbonylprolyloxymethyl)pyrrolidine
Comments Computed using HOSE algorithm
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Exact Mass 436.211055394 u
Formula C24H28N4O4
InChI InChI=1S/C24H28N4O4/c29-23(22-14-8-15-27(22)24(30)32-17-19-9-3-1-4-10-19)31-18-21-13-7-16-28(21)26-25-20-11-5-2-6-12-20/h1-6,9-12,21-22H,7-8,13-18H2/b26-25+
InChIKey OCLCAAVPIUIJNE-OCEACIFDSA-N
Molecular Weight 436.512 g/mol
SMILES C(N1C(C(OCC2N(\N=N\C3=CC=CC=C3)CCC2)=O)CCC1)(OCC1=CC=CC=C1)=O