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Ethyl 4-(1,3-dioxoindan-2-ylidene)-7-methyl-6,8-dioxo-3,7-diazabicyclo[3.3.0]octane-2-carboxylate
SpectraBase Compound ID 3TuXYHnLogw
InChI InChI=1S/C19H16N2O6/c1-3-27-19(26)14-11-10(17(24)21(2)18(11)25)13(20-14)12-15(22)8-6-4-5-7-9(8)16(12)23/h4-7,10-11,14,20H,3H2,1-2H3
InChIKey BBJQQNXEHQMOCQ-UHFFFAOYSA-N
Mol Weight 368.35 g/mol
Molecular Formula C19H16N2O6
Exact Mass 368.100836 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2ZxRIm6IKFy
Name Ethyl 4-(1,3-dioxoindan-2-ylidene)-7-methyl-6,8-dioxo-3,7-diazabicyclo[3.3.0]octane-2-carboxylate
CAS Registry Number 117457-18-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H16N2O6
InChI InChI=1S/C19H16N2O6/c1-3-27-19(26)14-11-10(17(24)21(2)18(11)25)13(20-14)12-15(22)8-6-4-5-7-9(8)16(12)23/h4-7,10-11,14,20H,3H2,1-2H3
InChIKey BBJQQNXEHQMOCQ-UHFFFAOYSA-N
Molecular Weight 368.345 g/mol
SMILES N1C(C2C(C1=C1C(c3ccccc3C1=O)=O)C(N(C2=O)C)=O)C(=O)OCC
SPLASH splash10-000j-0092000000-18fa39ad029a7a07f171
Source of Spectrum KC-1988-544-12
Synonyms Ethyl 3-(1,3-dioxo-1,3-dihydro-2H-inden-2-ylidene)-5-methyl-4,6-dioxooctahydropyrrolo[3,4-c]pyrrole-1-carboxylate
Wiley ID 1352915