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Methyl 6-methyl-11,13-dioxo-12-phenyl-12-aza-tricyclo[8.3.0.0(3,8)]tridec-4,7-dien-5-carboxylate
SpectraBase Compound ID 9O2Ab0MqmQU
InChI InChI=1S/C21H21NO4/c1-12-8-13-10-17-18(11-14(13)9-16(12)21(25)26-2)20(24)22(19(17)23)15-6-4-3-5-7-15/h3-9,12,14,17-18H,10-11H2,1-2H3
InChIKey AKSURELLZQIDAP-UHFFFAOYSA-N
Mol Weight 351.4 g/mol
Molecular Formula C21H21NO4
Exact Mass 351.147058 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BsEC5tiQwRy
Name Methyl 6-methyl-11,13-dioxo-12-phenyl-12-aza-tricyclo[8.3.0.0(3,8)]tridec-4,7-dien-5-carboxylate
CAS Registry Number 108200-89-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H21NO4
InChI InChI=1S/C21H21NO4/c1-12-8-13-10-17-18(11-14(13)9-16(12)21(25)26-2)20(24)22(19(17)23)15-6-4-3-5-7-15/h3-9,12,14,17-18H,10-11H2,1-2H3
InChIKey AKSURELLZQIDAP-UHFFFAOYSA-N
Molecular Weight 351.402 g/mol
SMILES C1(N(C(C2CC3C=C(C(C=C3CC12)C)C(=O)OC)=O)c1ccccc1)=O
SPLASH splash10-0uxr-0009000000-4d43befe83206819e975
Source of Spectrum AJ-59-1875-34
Synonyms Methyl 7-methyl-1,3-dioxo-2-phenyl-2,3,3a,4,4a,7,9,9a-octahydro-1H-benzo[f]isoindole-6-carboxylate
Wiley ID 1342688