CID 66465767

2-[(2-chlorophenyl)methyl]-2-methylpyrrolidine hydrochloride

Structural Information

Molecular Formula
C12H16ClN
SMILES
CC1(CCCN1)CC2=CC=CC=C2Cl
InChI
InChI=1S/C12H16ClN/c1-12(7-4-8-14-12)9-10-5-2-3-6-11(10)13/h2-3,5-6,14H,4,7-9H2,1H3
InChIKey
OYGVNYLYBTYCQK-UHFFFAOYSA-N
Compound name
2-[(2-chlorophenyl)methyl]-2-methylpyrrolidine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

209.09712 Da
Monoisotopic Mass

3.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 210.104396 147.0
[M+Na]+ 232.086338 154.7
[M-H]- 208.089844 150.6
[M+NH4]+ 227.130943 168.3
[M+K]+ 248.060278 149.1
[M+H-H2O]+ 192.094380 141.0
[M+HCOO]- 254.095321 162.6
[M+CH3COO]- 268.110971 159.2
[M+Na-2H]- 230.071786 150.8
[M]+ 209.09657142 144.5
[M]- 209.09766858 144.5
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.