CID 55269312

2-(4-chlorophenyl)-2-cyclopropylethan-1-amine hydrochloride

Structural Information

Molecular Formula
C11H14ClN
SMILES
C1CC1C(CN)C2=CC=C(C=C2)Cl
InChI
InChI=1S/C11H14ClN/c12-10-5-3-9(4-6-10)11(7-13)8-1-2-8/h3-6,8,11H,1-2,7,13H2
InChIKey
FFHOVLBOLZUYQE-UHFFFAOYSA-N
Compound name
2-(4-chlorophenyl)-2-cyclopropylethanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

195.08148 Da
Monoisotopic Mass

2.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 196.08876 136.4
[M+Na]+ 218.07070 145.2
[M-H]- 194.07420 143.1
[M+NH4]+ 213.11530 151.4
[M+K]+ 234.04464 140.3
[M+H-H2O]+ 178.07874 130.6
[M+HCOO]- 240.07968 156.0
[M+CH3COO]- 254.09533 188.9
[M+Na-2H]- 216.05615 141.4
[M]+ 195.08093 138.2
[M]- 195.08203 138.2
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

No patent data available for this compound.