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2,7-Bis(2-propylcyclohexylmethyl)benzo[lmn][3,8]phenanthroline-1,3,6,8-tetrone
SpectraBase Compound ID FfLTl8shpYC
InChI InChI=1S/C34H42N2O4/c1-3-9-21-11-5-7-13-23(21)19-35-31(37)25-15-17-27-30-28(18-16-26(29(25)30)32(35)38)34(40)36(33(27)39)20-24-14-8-6-12-22(24)10-4-2/h15-18,21-24H,3-14,19-20H2,1-2H3
InChIKey VZSVJWPQDGDUIE-UHFFFAOYSA-N
Mol Weight 542.7 g/mol
Molecular Formula C34H42N2O4
Exact Mass 542.314458 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID D80IvZe6hwP
Name 2,7-Bis(2-propylcyclohexylmethyl)benzo[lmn][3,8]phenanthroline-1,3,6,8-tetrone
Alternate Name(s) 2,7-bis[(2-propylcyclohexyl)methyl]benzo[lmn][3,8]phenanthroline-1,3,6,8(2H,7H)-tetrone
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C34H42N2O4
InChI InChI=1S/C34H42N2O4/c1-3-9-21-11-5-7-13-23(21)19-35-31(37)25-15-17-27-30-28(18-16-26(29(25)30)32(35)38)34(40)36(33(27)39)20-24-14-8-6-12-22(24)10-4-2/h15-18,21-24H,3-14,19-20H2,1-2H3
InChIKey VZSVJWPQDGDUIE-UHFFFAOYSA-N
Molecular Weight 542.720 g/mol
SMILES C1(N(C(c2ccc3C(N(C(c4ccc1c2c34)=O)CC1C(CCC)CCCC1)=O)=O)CC1C(CCC)CCCC1)=O
SPLASH splash10-00kf-0010790000-216eba4af40ac5466aad
Source of Spectrum QE-12-2819-1
Wiley ID 1586813