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4,5,6-Tris(1-methyl-1H-indol-3-yl)-1,3-benzenediol

View entire compound with spectra: 1 MS (GC)

4,5,6-Tris(1-methyl-1H-indol-3-yl)-1,3-benzenediol
SpectraBase Compound ID 4opoLl3aJWl
InChI InChI=1S/C33H27N3O2/c1-34-17-23(20-10-4-7-13-26(20)34)31-29(37)16-30(38)32(24-18-35(2)27-14-8-5-11-21(24)27)33(31)25-19-36(3)28-15-9-6-12-22(25)28/h4-19,37-38H,1-3H3
InChIKey AYNFVCHKXRWCQL-UHFFFAOYSA-N
Mol Weight 497.6 g/mol
Molecular Formula C33H27N3O2
Exact Mass 497.210327 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9TFcGxPXHSJ
Name 4,5,6-Tris(1-methyl-1H-indol-3-yl)-1,3-benzenediol
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C33H27N3O2
InChI InChI=1S/C33H27N3O2/c1-34-17-23(20-10-4-7-13-26(20)34)31-29(37)16-30(38)32(24-18-35(2)27-14-8-5-11-21(24)27)33(31)25-19-36(3)28-15-9-6-12-22(25)28/h4-19,37-38H,1-3H3
InChIKey AYNFVCHKXRWCQL-UHFFFAOYSA-N
Molecular Weight 497.598 g/mol
SMILES Oc1cc(c(c(c1-c1c[n](c2c1cccc2)C)-c1c[n](c2c1cccc2)C)-c1c[n](c2c1cccc2)C)O
SPLASH splash10-014i-0009100000-500217204ce5c9f9d5df
Source of Spectrum KC-61-10900-18
Wiley ID 1631143