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N-(1-Nonyldecyl)-N'-(2-hydroxyethyl)perylene-3,4:9,10-tetracarboxylic bisimide
SpectraBase Compound ID I5ksRlfeJbE
InChI InChI=1S/C45H52N2O5/c1-3-5-7-9-11-13-15-17-29(18-16-14-12-10-8-6-4-2)47-44(51)36-25-21-32-30-19-23-34-40-35(43(50)46(27-28-48)42(34)49)24-20-31(38(30)40)33-22-26-37(45(47)52)41(36)39(32)33/h19-26,29,48H,3-18,27-28H2,1-2H3
InChIKey YLSWVFIZRQUBBA-UHFFFAOYSA-N
Mol Weight 700.9 g/mol
Molecular Formula C45H52N2O5
Exact Mass 700.387623 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3LzXb7Slhg
Name N-(1-Nonyldecyl)-N'-(2-hydroxyethyl)perylene-3,4:9,10-tetracarboxylic bisimide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C45H52N2O5
InChI InChI=1S/C45H52N2O5/c1-3-5-7-9-11-13-15-17-29(18-16-14-12-10-8-6-4-2)47-44(51)36-25-21-32-30-19-23-34-40-35(43(50)46(27-28-48)42(34)49)24-20-31(38(30)40)33-22-26-37(45(47)52)41(36)39(32)33/h19-26,29,48H,3-18,27-28H2,1-2H3
InChIKey YLSWVFIZRQUBBA-UHFFFAOYSA-N
Molecular Weight 700.920 g/mol
SMILES OCCN1C(c2c3c4c(c5ccc6C(N(C(c7ccc(c5c67)c4cc2)=O)C(CCCCCCCCC)CCCCCCCCC)=O)ccc3C1=O)=O
SPLASH splash10-001u-0008907300-d9d47f20cf83894a70f4
Source of Spectrum QF-8-5636-8
Synonyms 2-(2-hydroxyethyl)-9-(1-nonyldecyl)isoquino[6',5',4':10,5,6]anthra[2,1,9-def]isoquinoline-1,3,8,10(2H,9H)-tetrone
Wiley ID 1558137