CID 11195052

2-(3,5-dichlorophenyl)propan-2-amine

Structural Information

Molecular Formula
C9H11Cl2N
SMILES
CC(C)(C1=CC(=CC(=C1)Cl)Cl)N
InChI
InChI=1S/C9H11Cl2N/c1-9(2,12)6-3-7(10)5-8(11)4-6/h3-5H,12H2,1-2H3
InChIKey
AZEJGVWRTXUSHS-UHFFFAOYSA-N
Compound name
2-(3,5-dichlorophenyl)propan-2-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

61
Patents

203.02686 Da
Monoisotopic Mass

2.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 204.03414 141.6
[M+Na]+ 226.01608 151.6
[M-H]- 202.01958 144.6
[M+NH4]+ 221.06068 162.1
[M+K]+ 241.99002 146.1
[M+H-H2O]+ 186.02412 138.2
[M+HCOO]- 248.02506 155.2
[M+CH3COO]- 262.04071 186.7
[M+Na-2H]- 224.00153 146.8
[M]+ 203.02631 143.0
[M]- 203.02741 143.0
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