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(2S)-methyl 2-((2-nitrobenzyl)(2-oxocyclobutyl)amino)-3-phenylpropanoate
SpectraBase Compound ID FZAJkagOA9n
InChI InChI=1S/C21H22N2O5/c1-28-21(25)19(13-15-7-3-2-4-8-15)22(18-11-12-20(18)24)14-16-9-5-6-10-17(16)23(26)27/h2-10,18-19H,11-14H2,1H3/t18?,19-/m0/s1
InChIKey AGJLLHVEMNXAGQ-GGYWPGCISA-N
Mol Weight 382.42 g/mol
Molecular Formula C21H22N2O5
Exact Mass 382.152872 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9CNtq85gtPU
Name (2S)-methyl 2-((2-nitrobenzyl)(2-oxocyclobutyl)amino)-3-phenylpropanoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H22N2O5
InChI InChI=1S/C21H22N2O5/c1-28-21(25)19(13-15-7-3-2-4-8-15)22(18-11-12-20(18)24)14-16-9-5-6-10-17(16)23(26)27/h2-10,18-19H,11-14H2,1H3/t18?,19-/m0/s1
InChIKey AGJLLHVEMNXAGQ-GGYWPGCISA-N
Molecular Weight 382.416 g/mol
SMILES C(=O)([C@](Cc1ccccc1)(N(Cc1c(cccc1)[N+](=O)[O-])C1C(CC1)=O)[H])OC
SPLASH splash10-00dr-1390000000-b4c7af496084d594ab68
Source of Spectrum AJO-3-378/SM4-3e
Wiley ID 1769993