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N,N'-1,8 : 4,5-Naphthalene(tetracarboxodiimido)-[4]-4,5,9,10-tetrahydropyrene
SpectraBase Compound ID J0q6Op7fQA0
InChI InChI=1S/C38H32N2O4/c41-35-27-11-13-29-34-30-14-12-28(33(27)34)36(42)39(35)15-3-1-5-21-17-23-7-9-25-19-22(6-2-4-16-40(37(29)43)38(30)44)20-26-10-8-24(18-21)31(23)32(25)26/h11-14,17-20H,1-10,15-16H2
InChIKey JKERELROZIWTBG-UHFFFAOYSA-N
Mol Weight 580.7 g/mol
Molecular Formula C38H32N2O4
Exact Mass 580.236208 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4CY1Nc0rOcH
Name N,N'-1,8 : 4,5-Naphthalene(tetracarboxodiimido)-[4]-4,5,9,10-tetrahydropyrene
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Formula C38H32N2O4
InChI InChI=1S/C38H32N2O4/c41-35-27-11-13-29-34-30-14-12-28(33(27)34)36(42)39(35)15-3-1-5-21-17-23-7-9-25-19-22(6-2-4-16-40(37(29)43)38(30)44)20-26-10-8-24(18-21)31(23)32(25)26/h11-14,17-20H,1-10,15-16H2
InChIKey JKERELROZIWTBG-UHFFFAOYSA-N
Molecular Weight 580.684 g/mol
SMILES C1(N2C(c3c4c5c(C(N(C(c5ccc14)=O)CCCCc1cc4c5-c6c(cc(cc6CC4)CCCC2)CCc5c1)=O)cc3)=O)=O
SPLASH splash10-001i-0010090000-32062955304d20d38618
Source of Spectrum U-1997-1556-0
Wiley ID 769950