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N-(2'.3'-Dihydroxypropyl)-N'-(1"-hexylheptyl)-perylene-2,3 : 9,10-bis(dicarboxamide)
SpectraBase Compound ID BihxV2DFSZn
InChI InChI=1S/C40H42N2O6/c1-3-5-7-9-11-23(12-10-8-6-4-2)42-39(47)31-19-15-27-25-13-17-29-35-30(38(46)41(37(29)45)21-24(44)22-43)18-14-26(33(25)35)28-16-20-32(40(42)48)36(31)34(27)28/h13-20,23-24,43-44H,3-12,21-22H2,1-2H3
InChIKey JUHUKGCEOZAYDI-UHFFFAOYSA-N
Mol Weight 646.8 g/mol
Molecular Formula C40H42N2O6
Exact Mass 646.304287 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID E92hnmqSteU
Name N-(2'.3'-Dihydroxypropyl)-N'-(1"-hexylheptyl)-perylene-2,3 : 9,10-bis(dicarboxamide)
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C40H42N2O6
InChI InChI=1S/C40H42N2O6/c1-3-5-7-9-11-23(12-10-8-6-4-2)42-39(47)31-19-15-27-25-13-17-29-35-30(38(46)41(37(29)45)21-24(44)22-43)18-14-26(33(25)35)28-16-20-32(40(42)48)36(31)34(27)28/h13-20,23-24,43-44H,3-12,21-22H2,1-2H3
InChIKey JUHUKGCEOZAYDI-UHFFFAOYSA-N
Molecular Weight 646.784 g/mol
SMILES OC(CO)CN1C(c2ccc3c4ccc5C(=O)N(C(c6ccc(c4c56)c4ccc(c2c34)C1=O)=O)C(CCCCCC)CCCCCC)=O
SPLASH splash10-0udl-1004903000-c0d68c8a9c590257a3fd
Source of Spectrum Y2-71-630-3
Wiley ID 1587557