CID 53841021

2241128-64-1

Structural Information

Molecular Formula
C9H9Cl2N
SMILES
C1[C@H]([C@@H]1N)C2=CC(=CC(=C2)Cl)Cl
InChI
InChI=1S/C9H9Cl2N/c10-6-1-5(2-7(11)3-6)8-4-9(8)12/h1-3,8-9H,4,12H2/t8-,9+/m0/s1
InChIKey
GJBXYYOESOABGQ-DTWKUNHWSA-N
Compound name
(1R,2S)-2-(3,5-dichlorophenyl)cyclopropan-1-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

10
Patents

201.0112 Da
Monoisotopic Mass

2.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 202.01848 135.3
[M+Na]+ 224.00042 151.4
[M+NH4]+ 219.04502 146.0
[M+K]+ 239.97436 144.9
[M-H]- 200.00392 146.5
[M+Na-2H]- 221.98587 146.3
[M]+ 201.01065 142.5
[M]- 201.01175 142.5
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