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(2Z,2'E)-2,2'-(2-Phenylpropane-1,3-diylidene) bis(5-nitro-1,3,3-trimethylindole)
SpectraBase Compound ID 3brfDUeEsMb
InChI InChI=1S/C31H32N4O4/c1-30(2)24-18-22(34(36)37)12-14-26(24)32(5)28(30)16-21(20-10-8-7-9-11-20)17-29-31(3,4)25-19-23(35(38)39)13-15-27(25)33(29)6/h7-19,21H,1-6H3/b28-16-,29-17+
InChIKey LXYJXXUHUFVGKC-PSUTYVDASA-N
Mol Weight 524.6 g/mol
Molecular Formula C31H32N4O4
Exact Mass 524.242356 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9b8kPKmhtXq
Name (2Z,2'E)-2,2'-(2-Phenylpropane-1,3-diylidene) bis(5-nitro-1,3,3-trimethylindole)
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C31H32N4O4
InChI InChI=1S/C31H32N4O4/c1-30(2)24-18-22(34(36)37)12-14-26(24)32(5)28(30)16-21(20-10-8-7-9-11-20)17-29-31(3,4)25-19-23(35(38)39)13-15-27(25)33(29)6/h7-19,21H,1-6H3/b28-16-,29-17+
InChIKey LXYJXXUHUFVGKC-PSUTYVDASA-N
Molecular Weight 524.621 g/mol
SMILES c12N(\C(C(c1cc(cc2)N(=O)=O)(C)C)=C\C(\C=C/1N(c2ccc(N(=O)=O)cc2C1(C)C)C)c1ccccc1)C
SPLASH splash10-004i-0120900000-acb315e04a532b681dc9
Source of Spectrum F-66-8106-LT3
Wiley ID 1684631