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2-(Benzo[d][1,3]dioxol-5-ylmethyl)-1H-pyrrolo[3,4-b]quinoline-1,3(2H)-dione
SpectraBase Compound ID IIMIgBk8Y5J
InChI InChI=1S/C19H12N2O4/c22-18-13-8-12-3-1-2-4-14(12)20-17(13)19(23)21(18)9-11-5-6-15-16(7-11)25-10-24-15/h1-8H,9-10H2
InChIKey JJCXGSWEIRCLQQ-UHFFFAOYSA-N
Mol Weight 332.32 g/mol
Molecular Formula C19H12N2O4
Exact Mass 332.079707 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HuPlbwevLmK
Name 2-(Benzo[d][1,3]dioxol-5-ylmethyl)-1H-pyrrolo[3,4-b]quinoline-1,3(2H)-dione
Appearance Yellow solid
Carrier Gas Helium
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 332.079706870 u
Formula C19H12N2O4
GC Oven Program Oven temp 320oC
InChI InChI=1S/C19H12N2O4/c22-18-13-8-12-3-1-2-4-14(12)20-17(13)19(23)21(18)9-11-5-6-15-16(7-11)25-10-24-15/h1-8H,9-10H2
InChIKey JJCXGSWEIRCLQQ-UHFFFAOYSA-N
Instrument Name Shimadzu GCMS-2020
Ionization Type EI
Literature Reference DOI 10.1002/ejoc.202201374
Molecular Weight 332.315 g/mol
Quality 371
Reported Formula C19H12N2O4
SMILES C1=CC(=CC=2OCOC12)CN1C(C2=NC3=C(C=C2C1=O)C=CC=C3)=O
SPLASH splash10-0a59-4492000000-bcd3d885d581b7dcab0b
Source of Spectrum K1-26-SM12-3r (DOI: 10.1002/ejoc.202201374)
Thin-Layer Chromatography 0.5 (CHCl3/EtOAc, 99:1)
Wiley ID 1910415