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2-(4-Hydroxy-3-methoxybenzyl)-1H-pyrrolo[3,4-b]quinoline-1,3(2H)-dione
SpectraBase Compound ID IbkqtkdLej5
InChI InChI=1S/C19H14N2O4/c1-25-16-8-11(6-7-15(16)22)10-21-18(23)13-9-12-4-2-3-5-14(12)20-17(13)19(21)24/h2-9,22H,10H2,1H3
InChIKey WTGCZGDLFPFRJW-UHFFFAOYSA-N
Mol Weight 334.33 g/mol
Molecular Formula C19H14N2O4
Exact Mass 334.095357 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HzGIOWU1577
Name 2-(4-Hydroxy-3-methoxybenzyl)-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 334.095356935 u
Formula C19H14N2O4
GC Oven Program Oven temp 320oC
InChI InChI=1S/C19H14N2O4/c1-25-16-8-11(6-7-15(16)22)10-21-18(23)13-9-12-4-2-3-5-14(12)20-17(13)19(21)24/h2-9,22H,10H2,1H3
InChIKey WTGCZGDLFPFRJW-UHFFFAOYSA-N
Instrument Name Shimadzu GCMS-2020
Ionization Type EI
Literature Reference DOI 10.1002/ejoc.202201374
Molecular Weight 334.331 g/mol
Quality 15
Reported Formula C19H14N2O4
SMILES OC1=C(C=C(C=C1)CN1C(C2=NC3=C(C=C2C1=O)C=CC=C3)=O)OC
SPLASH splash10-0a59-5291000000-591940bb01134a8c0cbc
Source of Spectrum K1-26-SM12-3t (DOI: 10.1002/ejoc.202201374)
Thin-Layer Chromatography 0.5 (CHCl3/EtOAc, 85:15)
Wiley ID 1910417