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Ethyl 4-(3-nitrophenyl)-6,8-dioxo7-phenyl-3,7-diazabicyclo[3.3.0]octan-2-carboxylate
SpectraBase Compound ID 2edShD4kSRj
InChI InChI=1S/C21H19N3O6/c1-2-30-21(27)18-16-15(17(22-18)12-7-6-10-14(11-12)24(28)29)19(25)23(20(16)26)13-8-4-3-5-9-13/h3-11,15-18,22H,2H2,1H3
InChIKey FHSMRUBKDMTPSD-UHFFFAOYSA-N
Mol Weight 409.4 g/mol
Molecular Formula C21H19N3O6
Exact Mass 409.127385 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GqbS4ccXxa4
Name Ethyl 4-(3-nitrophenyl)-6,8-dioxo7-phenyl-3,7-diazabicyclo[3.3.0]octan-2-carboxylate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H19N3O6
InChI InChI=1S/C21H19N3O6/c1-2-30-21(27)18-16-15(17(22-18)12-7-6-10-14(11-12)24(28)29)19(25)23(20(16)26)13-8-4-3-5-9-13/h3-11,15-18,22H,2H2,1H3
InChIKey FHSMRUBKDMTPSD-UHFFFAOYSA-N
Molecular Weight 409.398 g/mol
SMILES N1C(C2C(C1C(=O)OCC)C(N(C2=O)c1ccccc1)=O)c1cc(N(=O)=O)ccc1
SPLASH splash10-000i-0904400000-126bca1b64453f9f1232
Source of Spectrum KC-0-2843-16
Synonyms Ethyl 3-(3-nitrophenyl)-4,6-dioxo-5-phenyloctahydropyrrolo[3,4-c]pyrrole-1-carboxylate
Wiley ID 826432