CID 3103958

1-carbazol-9-yl-3-(3-chloro-phenylamino)-propan-2-ol

Structural Information

Molecular Formula
C21H19ClN2O
SMILES
C1=CC=C2C(=C1)C3=CC=CC=C3N2CC(CNC4=CC(=CC=C4)Cl)O
InChI
InChI=1S/C21H19ClN2O/c22-15-6-5-7-16(12-15)23-13-17(25)14-24-20-10-3-1-8-18(20)19-9-2-4-11-21(19)24/h1-12,17,23,25H,13-14H2
InChIKey
KITYXOSZSFHNRT-UHFFFAOYSA-N
Compound name
1-carbazol-9-yl-3-(3-chloroanilino)propan-2-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

350.1186 Da
Monoisotopic Mass

5.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 351.12588 182.7
[M+Na]+ 373.10782 199.2
[M+NH4]+ 368.15242 192.4
[M+K]+ 389.08176 190.6
[M-H]- 349.11132 188.7
[M+Na-2H]- 371.09327 191.4
[M]+ 350.11805 187.3
[M]- 350.11915 187.3
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

No patent data available for this compound.