CID 106826

67801-36-9

Structural Information

Molecular Formula
C26H32N2O
SMILES
CC(CCCC(C)(C)O)CC(N1C=CC2=CC=CC=C21)N3C=CC4=CC=CC=C43
InChI
InChI=1S/C26H32N2O/c1-20(9-8-16-26(2,3)29)19-25(27-17-14-21-10-4-6-12-23(21)27)28-18-15-22-11-5-7-13-24(22)28/h4-7,10-15,17-18,20,25,29H,8-9,16,19H2,1-3H3
InChIKey
YKLKFIPZNHLBMW-UHFFFAOYSA-N
Compound name
8,8-di(indol-1-yl)-2,6-dimethyloctan-2-ol
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

114
Patents

388.25146 Da
Monoisotopic Mass

6.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 389.25874 197.8
[M+Na]+ 411.24068 211.1
[M+NH4]+ 406.28528 205.4
[M+K]+ 427.21462 206.5
[M-H]- 387.24418 201.0
[M+Na-2H]- 409.22613 204.1
[M]+ 388.25091 200.8
[M]- 388.25201 200.8
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe