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1H-Pyrrole-2,5-dione, 1,1'-[(3-oxo-1(3H)-isobenzofuranylidene)di-4,1-phenylene]bis[3-methyl -
SpectraBase Compound ID 2nOgwcOenjz
InChI InChI=1S/C30H20N2O6/c1-17-15-25(33)31(27(17)35)21-11-7-19(8-12-21)30(24-6-4-3-5-23(24)29(37)38-30)20-9-13-22(14-10-20)32-26(34)16-18(2)28(32)36/h3-16H,1-2H3
InChIKey AHBVXTXHHSMBGU-UHFFFAOYSA-N
Mol Weight 504.5 g/mol
Molecular Formula C30H20N2O6
Exact Mass 504.132136 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID D30g8b6fWkp
Name 1H-Pyrrole-2,5-dione, 1,1'-[(3-oxo-1(3H)-isobenzofuranylidene)di-4,1-phenylene]bis[3-methyl -
Alternate Name(s) 3,3-bis(p-citraconimidophenyl)phthalide 3-Methyl-1-(4-{1-[4-(3-methyl-2,5-dioxo-2,5-dihydro-1H-pyrrol-1-yl)phenyl]-3-oxo-1,3-dihydro-2-benzofuran-1-yl}phenyl)-1H-pyrrole-2,5-dione
CAS Registry Number 78588-58-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C30H20N2O6
InChI InChI=1S/C30H20N2O6/c1-17-15-25(33)31(27(17)35)21-11-7-19(8-12-21)30(24-6-4-3-5-23(24)29(37)38-30)20-9-13-22(14-10-20)32-26(34)16-18(2)28(32)36/h3-16H,1-2H3
InChIKey AHBVXTXHHSMBGU-UHFFFAOYSA-N
Molecular Weight 504.498 g/mol
SMILES C1(N(C(C(=C1)C)=O)c1ccc(C2(OC(=O)c3c2cccc3)c2ccc(N3C(C=C(C3=O)C)=O)cc2)cc1)=O
SPLASH splash10-0udi-3900030000-312e97871228f9848185
Source of Spectrum O-16-145-1
Wiley ID 1399609