CID 56211

91324-15-1

Structural Information

Molecular Formula
C21H26N2O
SMILES
C1CCCN(CC1)CC(CN2C3=CC=CC=C3C4=CC=CC=C42)O
InChI
InChI=1S/C21H26N2O/c24-17(15-22-13-7-1-2-8-14-22)16-23-20-11-5-3-9-18(20)19-10-4-6-12-21(19)23/h3-6,9-12,17,24H,1-2,7-8,13-16H2
InChIKey
XZMXXDXFHOVSEF-UHFFFAOYSA-N
Compound name
1-(azepan-1-yl)-3-carbazol-9-ylpropan-2-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

2
References

0
Patents

322.2045 Da
Monoisotopic Mass

3.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 323.21178 178.8
[M+Na]+ 345.19372 189.9
[M+NH4]+ 340.23832 186.7
[M+K]+ 361.16766 184.6
[M-H]- 321.19722 182.3
[M+Na-2H]- 343.17917 184.3
[M]+ 322.20395 181.4
[M]- 322.20505 181.4
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.