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 146.1
[M+Na]+ 283.03752 155.5
[M-H]- 259.04102 151.2
[M+NH4]+ 278.08212 158.5
[M+K]+ 299.01146 148.6
[M+H-H2O]+ 243.04556 141.7
[M+HCOO]- 305.04650 160.5
[M+CH3COO]- 319.06215 199.8
[M+Na-2H]- 281.02297 149.0
[M]+ 260.04775 148.9
[M]- 260.04885 148.9
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