For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
1,3-Bis(3-hydroxy-1,3-dihydro-2H-pyrazolo[3,4-b]quinolin-2-yl)propane-1,3-dione
SpectraBase Compound ID 8pyRIsuOGk8
InChI InChI=1S/C23H18N6O4/c30-18(28-22(32)14-9-12-5-1-3-7-16(12)24-20(14)26-28)11-19(31)29-23(33)15-10-13-6-2-4-8-17(13)25-21(15)27-29/h1-10,22-23,32-33H,11H2,(H,24,26)(H,25,27)
InChIKey GTYQMBWWZZFHTF-UHFFFAOYSA-N
Mol Weight 442.44 g/mol
Molecular Formula C23H18N6O4
Exact Mass 442.138953 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID Ek0u8d28nlN
Name 1,3-Bis(3-hydroxy-1,3-dihydro-2H-pyrazolo[3,4-b]quinolin-2-yl)propane-1,3-dione
Appearance Red crystals
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C23H18N6O4
InChI InChI=1S/C23H18N6O4/c30-18(28-22(32)14-9-12-5-1-3-7-16(12)24-20(14)26-28)11-19(31)29-23(33)15-10-13-6-2-4-8-17(13)25-21(15)27-29/h1-10,22-23,32-33H,11H2,(H,24,26)(H,25,27)
InChIKey GTYQMBWWZZFHTF-UHFFFAOYSA-N
Instrument Name Shimadzu GC-MS QP-1000EX
Ionization Type EI
Literature Reference DOI 10.1002/jhet.3048
Molecular Weight 442.435 g/mol
SMILES N1N(C(CC(N2C(c3c(N2)nc2c(c3)cccc2)O)=O)=O)C(c2c1nc1ccccc1c2)O
SPLASH splash10-0pc0-0971000000-2d1b1f2a028790eabde8
Source of Spectrum Y-55-294-6
Wiley ID 1878789