CID 375837

Nsc656085

Structural Information

Molecular Formula
C28H20N2O2
SMILES
C1=CC=C(C=C1)C2=C(C3=CC=CC=C3N2O)C4=C(N(C5=CC=CC=C54)O)C6=CC=CC=C6
InChI
InChI=1S/C28H20N2O2/c31-29-23-17-9-7-15-21(23)25(27(29)19-11-3-1-4-12-19)26-22-16-8-10-18-24(22)30(32)28(26)20-13-5-2-6-14-20/h1-18,31-32H
InChIKey
FEDWHEJCPSWIEH-UHFFFAOYSA-N
Compound name
1-hydroxy-3-(1-hydroxy-2-phenylindol-3-yl)-2-phenylindole
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

416.15247 Da
Monoisotopic Mass

7.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 417.15975 200.3
[M+Na]+ 439.14169 211.5
[M-H]- 415.14519 212.0
[M+NH4]+ 434.18629 211.8
[M+K]+ 455.11563 202.2
[M+H-H2O]+ 399.14973 190.2
[M+HCOO]- 461.15067 220.4
[M+CH3COO]- 475.16632 210.5
[M+Na-2H]- 437.12714 201.6
[M]+ 416.15192 203.2
[M]- 416.15302 203.2
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

No patent data available for this compound.