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Dimethyl 4-benzyl-15-oxo-4,6,17-triazabicyclo[12.3.1]octadeca-1(17),6,11-triene-9,9-dicarboxylate
SpectraBase Compound ID BCd9dA9YwJy
InChI InChI=1S/C26H33N3O5/c1-33-24(31)26(25(32)34-2)14-7-6-12-21-18-22(27-28-23(21)30)13-17-29(16-9-8-15-26)19-20-10-4-3-5-11-20/h3-11,21H,12-19H2,1-2H3,(H,28,30)/b7-6-,9-8-
InChIKey MWALBEVZLSWSNX-JPDBVBESSA-N
Mol Weight 467.6 g/mol
Molecular Formula C26H33N3O5
Exact Mass 467.242021 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID ZFNElBxb6x
Name Dimethyl 4-benzyl-15-oxo-4,6,17-triazabicyclo[12.3.1]octadeca-1(17),6,11-triene-9,9-dicarboxylate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C26H33N3O5
InChI InChI=1S/C26H33N3O5/c1-33-24(31)26(25(32)34-2)14-7-6-12-21-18-22(27-28-23(21)30)13-17-29(16-9-8-15-26)19-20-10-4-3-5-11-20/h3-11,21H,12-19H2,1-2H3,(H,28,30)/b7-6-,9-8-
InChIKey MWALBEVZLSWSNX-JPDBVBESSA-N
Molecular Weight 467.566 g/mol
SMILES N1N=C2CCN(C\C=C/CC(C\C=C/CC(C1=O)C2)(C(=O)OC)C(=O)OC)Cc1ccccc1
SPLASH splash10-0006-9003100000-ca7bd41798735a3993cd
Source of Spectrum K1-2001-4205-37
Synonyms Dimethyl 4-benzyl-15-oxo-4,16,17-triazabicyclo[12.3.1]octadeca-1(17),6,11-triene-9,9-dicarboxylate
Wiley ID 813562