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N-Cyclohexylperylene-3,4-dicarboximide
SpectraBase Compound ID 3XPCrFwEnbX
InChI InChI=1S/C28H21NO2/c30-27-22-14-12-20-18-10-4-6-16-7-5-11-19(24(16)18)21-13-15-23(26(22)25(20)21)28(31)29(27)17-8-2-1-3-9-17/h4-7,10-15,17H,1-3,8-9H2
InChIKey BPIPXTYZLXPZDG-UHFFFAOYSA-N
Mol Weight 403.48 g/mol
Molecular Formula C28H21NO2
Exact Mass 403.157229 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8A9jXYVt2hy
Name N-Cyclohexylperylene-3,4-dicarboximide
Alternate Name(s) 2-cyclohexyl-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 C28H21NO2
InChI InChI=1S/C28H21NO2/c30-27-22-14-12-20-18-10-4-6-16-7-5-11-19(24(16)18)21-13-15-23(26(22)25(20)21)28(31)29(27)17-8-2-1-3-9-17/h4-7,10-15,17H,1-3,8-9H2
InChIKey BPIPXTYZLXPZDG-UHFFFAOYSA-N
Molecular Weight 403.481 g/mol
SMILES C1(N(C(c2c3c4c(ccc13)c1cccc3c1c(c4cc2)ccc3)=O)C1CCCCC1)=O
SPLASH splash10-00di-0039200000-75ffb8f69ad5282e8ba4
Source of Spectrum U-1995-1238-2
Wiley ID 767276