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5,14-diphenyl-11-methyl-5,14-diazatetracyclo[7.7.0.0(3,7).0(12,16)]hexadec-9-en-4,6,13,15-tetraone
SpectraBase Compound ID JNKb7wVSjlR
InChI InChI=1S/C27H24N2O4/c1-15-12-16-13-20-21(25(31)28(24(20)30)17-8-4-2-5-9-17)14-19(16)23-22(15)26(32)29(27(23)33)18-10-6-3-7-11-18/h2-12,15,19-23H,13-14H2,1H3
InChIKey ZOMNOKVTCZCOEM-UHFFFAOYSA-N
Mol Weight 440.5 g/mol
Molecular Formula C27H24N2O4
Exact Mass 440.173607 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID D1Nbav1VIfK
Name 5,14-diphenyl-11-methyl-5,14-diazatetracyclo[7.7.0.0(3,7).0(12,16)]hexadec-9-en-4,6,13,15-tetraone
CAS Registry Number 108200-74-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C27H24N2O4
InChI InChI=1S/C27H24N2O4/c1-15-12-16-13-20-21(25(31)28(24(20)30)17-8-4-2-5-9-17)14-19(16)23-22(15)26(32)29(27(23)33)18-10-6-3-7-11-18/h2-12,15,19-23H,13-14H2,1H3
InChIKey ZOMNOKVTCZCOEM-UHFFFAOYSA-N
Molecular Weight 440.499 g/mol
SMILES C1(N(C(C2CC3C4C(N(C(C4C(C=C3CC12)C)=O)c1ccccc1)=O)=O)c1ccccc1)=O
SPLASH splash10-0006-0110900000-8e3327420e9fc3f7d863
Source of Spectrum AJ-59-1872-12
Synonyms 4-Methyl-2,8-diphenyl-3a,4,6,6a,9a,10,10a,10b-octahydroisoindolo[5,6-e]isoindole-1,3,7,9(2H,8H)-tetrone
Wiley ID 1384799