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2,7-Bis(2-ethyl-2-phenylbutyl)benzo[lmn][3,8]phenanthroline-1,3,6,8-tetrone
SpectraBase Compound ID CMHoZQmdVR1
InChI InChI=1S/C38H38N2O4/c1-5-37(6-2,25-15-11-9-12-16-25)23-39-33(41)27-19-21-29-32-30(22-20-28(31(27)32)34(39)42)36(44)40(35(29)43)24-38(7-3,8-4)26-17-13-10-14-18-26/h9-22H,5-8,23-24H2,1-4H3
InChIKey TZBWJYRPHGLOCK-UHFFFAOYSA-N
Mol Weight 586.7 g/mol
Molecular Formula C38H38N2O4
Exact Mass 586.283158 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 734tCtxpwxl
Name 2,7-Bis(2-ethyl-2-phenylbutyl)benzo[lmn][3,8]phenanthroline-1,3,6,8-tetrone
Alternate Name(s) 2,7-bis(2-ethyl-2-phenylbutyl)benzo[lmn][3,8]phenanthroline-1,3,6,8(2H,7H)-tetrone
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C38H38N2O4
InChI InChI=1S/C38H38N2O4/c1-5-37(6-2,25-15-11-9-12-16-25)23-39-33(41)27-19-21-29-32-30(22-20-28(31(27)32)34(39)42)36(44)40(35(29)43)24-38(7-3,8-4)26-17-13-10-14-18-26/h9-22H,5-8,23-24H2,1-4H3
InChIKey TZBWJYRPHGLOCK-UHFFFAOYSA-N
Molecular Weight 586.732 g/mol
SMILES C1(N(C(c2ccc3C(N(C(c4ccc1c2c34)=O)CC(c1ccccc1)(CC)CC)=O)=O)CC(c1ccccc1)(CC)CC)=O
SPLASH splash10-052e-2900010000-5f9ab4fbce89221c8ee7
Source of Spectrum QE-12-2819-1
Wiley ID 1586812