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3,3'-((1,3-phenylenebis[azanediyl])bis(methanylylidene))bis(6-phenyl-2H-pyrano[3,2-c]quinoline-2,4,5(3H,6H)-trione)
SpectraBase Compound ID C4uwjVWRhu8
InChI InChI=1S/C44H26N4O8/c49-37-31(43(53)55-39-29-18-7-9-20-33(29)47(41(51)35(37)39)27-14-3-1-4-15-27)23-45-25-12-11-13-26(22-25)46-24-32-38(50)36-40(56-44(32)54)30-19-8-10-21-34(30)48(42(36)52)28-16-5-2-6-17-28/h1-24,45-46H
InChIKey APAKYZSWJWCBKR-UHFFFAOYSA-N
Mol Weight 738.7 g/mol
Molecular Formula C44H26N4O8
Exact Mass 738.175064 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1WL5bgAKsYq
Name 3,3'-((1,3-phenylenebis[azanediyl])bis(methanylylidene))bis(6-phenyl-2H-pyrano[3,2-c]quinoline-2,4,5(3H,6H)-trione)
Appearance Yellow crystals
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 738.175063805 u
Formula C44H26N4O8
InChI InChI=1S/C44H26N4O8/c49-37-31(43(53)55-39-29-18-7-9-20-33(29)47(41(51)35(37)39)27-14-3-1-4-15-27)23-45-25-12-11-13-26(22-25)46-24-32-38(50)36-40(56-44(32)54)30-19-8-10-21-34(30)48(42(36)52)28-16-5-2-6-17-28/h1-24,45-46H
InChIKey APAKYZSWJWCBKR-UHFFFAOYSA-N
Instrument Name Thermo scientific GCMS ISQ LT
Ionization Type EI
Literature Reference DOI 10.1002/jhet.4424
Molecular Weight 738.712 g/mol
SMILES N(C=1C=C(C=CC1)NC=C1C(C=2C(N(C=3C=CC=CC3C2OC1=O)C1=CC=CC=C1)=O)=O)C=C1C(C=2C(N(C=3C=CC=CC3C2OC1=O)C1=CC=CC=C1)=O)=O
SPLASH splash10-03k9-3439224400-0819489352112c880b00
Source of Spectrum Y-59-SM33-12 (DOI: 10.1002/jhet.4424)
Wiley ID 1892461