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N-Cyclooctylperylene-3,4-dicarboximide
SpectraBase Compound ID GxBGwtZfLnN
InChI InChI=1S/C30H25NO2/c32-29-24-16-14-22-20-12-6-8-18-9-7-13-21(26(18)20)23-15-17-25(28(24)27(22)23)30(33)31(29)19-10-4-2-1-3-5-11-19/h6-9,12-17,19H,1-5,10-11H2
InChIKey WRJVRADLDBPLIA-UHFFFAOYSA-N
Mol Weight 431.54 g/mol
Molecular Formula C30H25NO2
Exact Mass 431.188529 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1u3wevv7qzT
Name N-Cyclooctylperylene-3,4-dicarboximide
Alternate Name(s) 2-cyclooctyl-1H-benzo[10,5]anthra[2,1,9-def]isoquinoline-1,3(2H)-dione
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C30H25NO2
InChI InChI=1S/C30H25NO2/c32-29-24-16-14-22-20-12-6-8-18-9-7-13-21(26(18)20)23-15-17-25(28(24)27(22)23)30(33)31(29)19-10-4-2-1-3-5-11-19/h6-9,12-17,19H,1-5,10-11H2
InChIKey WRJVRADLDBPLIA-UHFFFAOYSA-N
Molecular Weight 431.535 g/mol
SMILES C1(N(C(c2c3c4c(ccc13)c1cccc3c1c(c4cc2)ccc3)=O)C1CCCCCCC1)=O
SPLASH splash10-00di-0009200000-7e8b5c5d99b6620bfaa6
Source of Spectrum U-1995-1238-2
Wiley ID 767274