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N,N'-Bis(2,6-diisopropyl-phenyl)-pepylene-3,4,9,10-tetracarboxylic acidimide
SpectraBase Compound ID 5cLzqJvsU4e
InChI InChI=1S/C48H42N2O4/c1-23(2)27-11-9-12-28(24(3)4)43(27)49-45(51)35-19-15-31-33-17-21-37-42-38(22-18-34(40(33)42)32-16-20-36(46(49)52)41(35)39(31)32)48(54)50(47(37)53)44-29(25(5)6)13-10-14-30(44)26(7)8/h9-26H,1-8H3
InChIKey NAZODJSYHDYJGP-UHFFFAOYSA-N
Mol Weight 710.9 g/mol
Molecular Formula C48H42N2O4
Exact Mass 710.314458 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8j2J6P3eLcD
Name 2,9-bis(2,6-diisopropylphenyl)anthra[2,1,9-def:6,5,10-d'e'f']diisoquinoline-1,3,8,10(2H,9H)-tetraone
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C48H42N2O4
InChI InChI=1S/C48H42N2O4/c1-23(2)27-11-9-12-28(24(3)4)43(27)49-45(51)35-19-15-31-33-17-21-37-42-38(22-18-34(40(33)42)32-16-20-36(46(49)52)41(35)39(31)32)48(54)50(47(37)53)44-29(25(5)6)13-10-14-30(44)26(7)8/h9-26H,1-8H3
InChIKey NAZODJSYHDYJGP-UHFFFAOYSA-N
Literature Reference DOI 10.1021/acs.orglett.5b03581
Molecular Weight 710.874 g/mol
SMILES c12c3c(c4c5c2ccc2c5c(cc4)C(N(C2=O)c2c(cccc2C(C)C)C(C)C)=O)ccc2C(N(C(c(c32)cc1)=O)c1c(cccc1C(C)C)C(C)C)=O
SPLASH splash10-014l-9047064500-1b7c5d52e07b7698423d
Source of Spectrum A1-18-544/SM9-PDI_1
Wiley ID 1805131