CID 217248

38339-13-8

Structural Information

Molecular Formula
C11H14Cl2N2O
SMILES
C1CC1NCC(C2=CC(=C(C(=C2)Cl)N)Cl)O
InChI
InChI=1S/C11H14Cl2N2O/c12-8-3-6(4-9(13)11(8)14)10(16)5-15-7-1-2-7/h3-4,7,10,15-16H,1-2,5,14H2
InChIKey
FRLAHIZRTFRSMT-UHFFFAOYSA-N
Compound name
1-(4-amino-3,5-dichlorophenyl)-2-(cyclopropylamino)ethanol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

6
Patents

260.0483 Da
Monoisotopic Mass

1.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 261.05558 150.2
[M+Na]+ 283.03752 163.5
[M+NH4]+ 278.08212 159.1
[M+K]+ 299.01146 158.5
[M-H]- 259.04102 160.4
[M+Na-2H]- 281.02297 159.1
[M]+ 260.04775 156.5
[M]- 260.04885 156.5
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