CID 62353990

3-(2-chlorophenyl)-2,2-dimethylpyrrolidine hydrochloride

Structural Information

Molecular Formula
C12H16ClN
SMILES
CC1(C(CCN1)C2=CC=CC=C2Cl)C
InChI
InChI=1S/C12H16ClN/c1-12(2)10(7-8-14-12)9-5-3-4-6-11(9)13/h3-6,10,14H,7-8H2,1-2H3
InChIKey
WWFJBGLZDJTNRG-UHFFFAOYSA-N
Compound name
3-(2-chlorophenyl)-2,2-dimethylpyrrolidine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

209.09712 Da
Monoisotopic Mass

2.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 210.104396 146.4
[M+Na]+ 232.086338 155.0
[M-H]- 208.089844 150.3
[M+NH4]+ 227.130943 168.0
[M+K]+ 248.060278 149.4
[M+H-H2O]+ 192.094380 140.7
[M+HCOO]- 254.095321 161.9
[M+CH3COO]- 268.110971 159.0
[M+Na-2H]- 230.071786 149.6
[M]+ 209.09657142 144.2
[M]- 209.09766858 144.2
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.