CID 87638

1,2-diphenylindole

Structural Information

Molecular Formula
C20H15N
SMILES
C1=CC=C(C=C1)C2=CC3=CC=CC=C3N2C4=CC=CC=C4
InChI
InChI=1S/C20H15N/c1-3-9-16(10-4-1)20-15-17-11-7-8-14-19(17)21(20)18-12-5-2-6-13-18/h1-15H
InChIKey
BRIKLJCDBBFRAE-UHFFFAOYSA-N
Compound name
1,2-diphenylindole
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

155
Patents

269.12045 Da
Monoisotopic Mass

5.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 270.12773 162.1
[M+Na]+ 292.10967 171.7
[M-H]- 268.11317 171.9
[M+NH4]+ 287.15427 179.5
[M+K]+ 308.08361 164.7
[M+H-H2O]+ 252.11771 152.9
[M+HCOO]- 314.11865 186.3
[M+CH3COO]- 328.13430 174.9
[M+Na-2H]- 290.09512 168.7
[M]+ 269.11990 162.6
[M]- 269.12100 162.6
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

patents stripe