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N-(1'-Hexylheptyl)perylene-3,.4-bis(methoxycarbonyl)-9,10-dicarboxylic - imide
SpectraBase Compound ID 34tv5O7Pc7j
InChI InChI=1S/C39H41NO6/c1-5-7-9-11-13-23(14-12-10-8-6-2)40-36(41)28-19-15-24-26-17-21-30(38(43)45-3)35-31(39(44)46-4)22-18-27(33(26)35)25-16-20-29(37(40)42)34(28)32(24)25/h15-23H,5-14H2,1-4H3
InChIKey HLKFXMHAKYKUGG-UHFFFAOYSA-N
Mol Weight 619.8 g/mol
Molecular Formula C39H41NO6
Exact Mass 619.293388 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IfeHebPoXJZ
Name N-(1'-Hexylheptyl)perylene-3,.4-bis(methoxycarbonyl)-9,10-dicarboxylic - imide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C39H41NO6
InChI InChI=1S/C39H41NO6/c1-5-7-9-11-13-23(14-12-10-8-6-2)40-36(41)28-19-15-24-26-17-21-30(38(43)45-3)35-31(39(44)46-4)22-18-27(33(26)35)25-16-20-29(37(40)42)34(28)32(24)25/h15-23H,5-14H2,1-4H3
InChIKey HLKFXMHAKYKUGG-UHFFFAOYSA-N
Molecular Weight 619.758 g/mol
SMILES C1(N(C(c2ccc3c4c2c1ccc4c1c2c(c(ccc32)C(=O)OC)c(cc1)C(=O)OC)=O)C(CCCCCC)CCCCCC)=O
SPLASH splash10-000i-0000901000-734305d22cd9617019c0
Source of Spectrum U-1995-485-8
Wiley ID 766638