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2-{bis[4-(dimethylamino)phenyl]methyl}-5-(dimethylamino)benzoic acid
SpectraBase Compound ID 4krDVharlqf
InChI InChI=1S/C26H31N3O2/c1-27(2)20-11-7-18(8-12-20)25(19-9-13-21(14-10-19)28(3)4)23-16-15-22(29(5)6)17-24(23)26(30)31/h7-17,25H,1-6H3,(H,30,31)
InChIKey BQGGOSXJLSPVRH-UHFFFAOYSA-N
Mol Weight 417.55 g/mol
Molecular Formula C26H31N3O2
Exact Mass 417.241627 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DJBDqZAWLxa
Name 2-{bis[4-(dimethylamino)phenyl]methyl}-5-(dimethylamino)benzoic acid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C26H31N3O2
InChI InChI=1S/C26H31N3O2/c1-27(2)20-11-7-18(8-12-20)25(19-9-13-21(14-10-19)28(3)4)23-16-15-22(29(5)6)17-24(23)26(30)31/h7-17,25H,1-6H3,(H,30,31)
InChIKey BQGGOSXJLSPVRH-UHFFFAOYSA-N
Molecular Weight 417.553 g/mol
SMILES OC(c1c(C(c2ccc(cc2)N(C)C)c2ccc(cc2)N(C)C)ccc(N(C)C)c1)=O
SPLASH splash10-0l6r-0592200000-faf45d1ff42363d0d270
Source of Spectrum IC-1139-0-0
Wiley ID 1376905