CID 10910315

1-(2,6-dichlorophenyl)ethanamine

Structural Information

Molecular Formula
C8H9Cl2N
SMILES
CC(C1=C(C=CC=C1Cl)Cl)N
InChI
InChI=1S/C8H9Cl2N/c1-5(11)8-6(9)3-2-4-7(8)10/h2-5H,11H2,1H3
InChIKey
NRWOZHOHRZOVDA-UHFFFAOYSA-N
Compound name
1-(2,6-dichlorophenyl)ethanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

36
Patents

189.0112 Da
Monoisotopic Mass

2.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 190.01848 135.7
[M+Na]+ 212.00042 150.0
[M+NH4]+ 207.04502 145.5
[M+K]+ 227.97436 142.4
[M-H]- 188.00392 138.9
[M+Na-2H]- 209.98587 143.2
[M]+ 189.01065 139.3
[M]- 189.01175 139.3
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

patents stripe