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N,N'-bis(1-butylpentyl)-3,4,9,10-perylenetetracarboxylic 3,4:9,10-diimide

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N,N'-bis(1-butylpentyl)-3,4,9,10-perylenetetracarboxylic 3,4:9,10-diimide
SpectraBase Compound ID GD4MsXxT2F2
InChI InChI=1S/C42H46N2O4/c1-5-9-13-25(14-10-6-2)43-39(45)31-21-17-27-29-19-23-33-38-34(42(48)44(41(33)47)26(15-11-7-3)16-12-8-4)24-20-30(36(29)38)28-18-22-32(40(43)46)37(31)35(27)28/h17-26H,5-16H2,1-4H3
InChIKey JCRLLXPDPLNZDE-UHFFFAOYSA-N
Mol Weight 642.8 g/mol
Molecular Formula C42H46N2O4
Exact Mass 642.345758 g/mol

Transmission Infrared (IR) Spectrum

Transmission Infrared (IR) Spectrum

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SpectraBase Spectrum ID 5oOCzDgwiQ
Name N,N'-BIS(1-BUTYLPENTYL)-3,4,9,10-PERYLENETETRACARBOXYLIC 3,4:9,10-DIIMIDE
Source of Sample H. Langhals, University of Munich, Munich, Germany
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C42H46N2O4
InChI InChI=1S/C42H46N2O4/c1-5-9-13-25(14-10-6-2)43-39(45)31-21-17-27-29-19-23-33-38-34(42(48)44(41(33)47)26(15-11-7-3)16-12-8-4)24-20-30(36(29)38)28-18-22-32(40(43)46)37(31)35(27)28/h17-26H,5-16H2,1-4H3
InChIKey JCRLLXPDPLNZDE-UHFFFAOYSA-N
Literature Reference CHEM. BER. 121, 225(1988) Abstract-Chemical Abstracts= 108, 96162B(1988)
Melting Point 268C
Molecular Weight 642.840027
Synonyms PERYLENETETRACARBOXYLIC 3,4:9,10- DIIMIDE, 3,4,9,10-, N,N*-BIS/1-BUTYL- PENTYL/-,
Technique KBr WAFER