CID 198327

2-(chloromethyl)-1-methylpyrrolidine hydrochloride

Structural Information

Molecular Formula
C6H12ClN
SMILES
CN1CCCC1CCl
InChI
InChI=1S/C6H12ClN/c1-8-4-2-3-6(8)5-7/h6H,2-5H2,1H3
InChIKey
ZXEQVHDPCGPJSJ-UHFFFAOYSA-N
Compound name
2-(chloromethyl)-1-methylpyrrolidine
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

68
Patents

133.06583 Da
Monoisotopic Mass

1.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 134.07311 125.6
[M+Na]+ 156.05505 137.2
[M+NH4]+ 151.09965 135.2
[M+K]+ 172.02899 132.0
[M-H]- 132.05855 127.0
[M+Na-2H]- 154.04050 130.8
[M]+ 133.06528 127.8
[M]- 133.06638 127.8
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