CID 66545623

N-(3-chlorophenyl)pyrrolidin-3-amine

Structural Information

Molecular Formula
C10H13ClN2
SMILES
C1CNCC1NC2=CC(=CC=C2)Cl
InChI
InChI=1S/C10H13ClN2/c11-8-2-1-3-9(6-8)13-10-4-5-12-7-10/h1-3,6,10,12-13H,4-5,7H2
InChIKey
GFHCSIJCLZAWKC-UHFFFAOYSA-N
Compound name
N-(3-chlorophenyl)pyrrolidin-3-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

196.07672 Da
Monoisotopic Mass

2.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 197.08400 142.4
[M+Na]+ 219.06594 149.0
[M-H]- 195.06944 145.7
[M+NH4]+ 214.11054 161.8
[M+K]+ 235.03988 143.6
[M+H-H2O]+ 179.07398 135.7
[M+HCOO]- 241.07492 159.5
[M+CH3COO]- 255.09057 154.3
[M+Na-2H]- 217.05139 146.7
[M]+ 196.07617 138.2
[M]- 196.07727 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.