CID 3993594

2-(2,3-dichlorophenyl)pyrrolidine

Structural Information

Molecular Formula
C10H11Cl2N
SMILES
C1CC(NC1)C2=C(C(=CC=C2)Cl)Cl
InChI
InChI=1S/C10H11Cl2N/c11-8-4-1-3-7(10(8)12)9-5-2-6-13-9/h1,3-4,9,13H,2,5-6H2
InChIKey
HZVTWBMAMRYGPD-UHFFFAOYSA-N
Compound name
2-(2,3-dichlorophenyl)pyrrolidine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

23
Patents

215.02686 Da
Monoisotopic Mass

3.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 216.03414 143.5
[M+Na]+ 238.01608 157.7
[M+NH4]+ 233.06068 153.4
[M+K]+ 253.99002 150.8
[M-H]- 214.01958 146.9
[M+Na-2H]- 236.00153 151.0
[M]+ 215.02631 147.0
[M]- 215.02741 147.0
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