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]+ 210.10440 146.4
[M+Na]+ 232.08634 155.0
[M-H]- 208.08984 150.3
[M+NH4]+ 227.13094 168.0
[M+K]+ 248.06028 149.4
[M+H-H2O]+ 192.09438 140.7
[M+HCOO]- 254.09532 161.9
[M+CH3COO]- 268.11097 159.0
[M+Na-2H]- 230.07179 149.6
[M]+ 209.09657 144.2
[M]- 209.09767 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.