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2-Benzyl-1H-pyrrolo[3,4-b]quinoline-1,3(2H)-dione

View entire compound with spectra: 1 MS (GC)

2-Benzyl-1H-pyrrolo[3,4-b]quinoline-1,3(2H)-dione
SpectraBase Compound ID 77TE3O4ikW3
InChI InChI=1S/C18H12N2O2/c21-17-14-10-13-8-4-5-9-15(13)19-16(14)18(22)20(17)11-12-6-2-1-3-7-12/h1-10H,11H2
InChIKey RRZOFQFJICWBLX-UHFFFAOYSA-N
Mol Weight 288.31 g/mol
Molecular Formula C18H12N2O2
Exact Mass 288.089878 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 54vua90MCwt
Name 2-Benzyl-1H-pyrrolo[3,4-b]quinoline-1,3(2H)-dione
Appearance Pale yellow solid
Carrier Gas Helium
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 288.089877632 u
Formula C18H12N2O2
GC Oven Program Oven temp 320oC
InChI InChI=1S/C18H12N2O2/c21-17-14-10-13-8-4-5-9-15(13)19-16(14)18(22)20(17)11-12-6-2-1-3-7-12/h1-10H,11H2
InChIKey RRZOFQFJICWBLX-UHFFFAOYSA-N
Instrument Name Shimadzu GCMS-2020
Ionization Type EI
Literature Reference DOI 10.1002/ejoc.202201374
Quality 334
Reported Formula C18H12N2O2
SMILES C1(=CC=CC=C1)CN1C(C2=NC3=C(C=C2C1=O)C=CC=C3)=O
SPLASH splash10-004r-1690000000-ba0a3f565897f71bfa96
Source of Spectrum K1-26-SM10-3l (DOI: 10.1002/ejoc.202201374)
Thin-Layer Chromatography 0.6 (n-Hexan/CHCl3/EtOAc, 40:40:20)
Wiley ID 1910410