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N,N'-dicyclopentyl-3,4,9,10-perylenetetracarboxylic 3,4:9,10-diimide
SpectraBase Compound ID 4SWTq4LMQnW
InChI InChI=1S/C34H26N2O4/c37-31-23-13-9-19-21-11-15-25-30-26(34(40)36(33(25)39)18-7-3-4-8-18)16-12-22(28(21)30)20-10-14-24(29(23)27(19)20)32(38)35(31)17-5-1-2-6-17/h9-18H,1-8H2
InChIKey LEHMHURNQVSVKR-UHFFFAOYSA-N
Mol Weight 526.6 g/mol
Molecular Formula C34H26N2O4
Exact Mass 526.189257 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LvALb9XZGEc
Name N,N'-dicyclopentyl-3,4,:9,10-perylenebis(dicarboximide)
Alternate Name(s) 2,9-Dicyclopentylisoquino[6',5',4':10,5,6]anthra[2,1,9-def]isoquinoline-1,3,8,10(2H,9H)-tetrone
CAS Registry Number 80509-52-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C34H26N2O4
InChI InChI=1S/C34H26N2O4/c37-31-23-13-9-19-21-11-15-25-30-26(34(40)36(33(25)39)18-7-3-4-8-18)16-12-22(28(21)30)20-10-14-24(29(23)27(19)20)32(38)35(31)17-5-1-2-6-17/h9-18H,1-8H2
InChIKey LEHMHURNQVSVKR-UHFFFAOYSA-N
Molecular Weight 526.592 g/mol
SMILES C1(N(C(c2c3c4c(ccc13)c1ccc3c5c1c(c4cc2)ccc5C(N(C3=O)C1CCCC1)=O)=O)C1CCCC1)=O
SPLASH splash10-0006-0009120000-77a14d4cf1f06460e0bf
Source of Spectrum K-121-227-2
Wiley ID 1402883