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3,3'-Methylenebis(4-hydroxy-6-phenyl-2H-pyrano[3,2-c]quinoline-2,5(6H)-dione)
SpectraBase Compound ID HA5OlK1HlPc
InChI InChI=1S/C37H22N2O8/c40-30-24(36(44)46-32-22-15-7-9-17-26(22)38(34(42)28(30)32)20-11-3-1-4-12-20)19-25-31(41)29-33(47-37(25)45)23-16-8-10-18-27(23)39(35(29)43)21-13-5-2-6-14-21/h1-18,40-41H,19H2
InChIKey JKXKMWOJOWSXTG-UHFFFAOYSA-N
Mol Weight 622.6 g/mol
Molecular Formula C37H22N2O8
Exact Mass 622.137616 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3lFmVzzSKm
Name 3,3'-Methylenebis(4-hydroxy-6-phenyl-2H-pyrano[3,2-c]quinoline-2,5(6H)-dione)
Appearance Colorless needles
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 622.137615668 u
Formula C37H22N2O8
InChI InChI=1S/C37H22N2O8/c40-30-24(36(44)46-32-22-15-7-9-17-26(22)38(34(42)28(30)32)20-11-3-1-4-12-20)19-25-31(41)29-33(47-37(25)45)23-16-8-10-18-27(23)39(35(29)43)21-13-5-2-6-14-21/h1-18,40-41H,19H2
InChIKey JKXKMWOJOWSXTG-UHFFFAOYSA-N
Instrument Name Thermo scientific GCMS ISQ LT
Ionization Type EI
Literature Reference DOI 10.1002/jhet.4424
Molecular Weight 622.589 g/mol
SMILES OC1=C(CC2=C(C=3C(N(C=4C=CC=CC4C3OC2=O)C2=CC=CC=C2)=O)O)C(OC=2C=3C=CC=CC3N(C(C12)=O)C1=CC=CC=C1)=O
SPLASH splash10-0159-4649562000-70d7aeba8af9cccd4863
Source of Spectrum Y-59-SM17-7 (DOI: 10.1002/jhet.4424)
Wiley ID 1892469