CID 11321028

1-(3-chloropropyl)-pyrrolidine

Structural Information

Molecular Formula
C7H14ClN
SMILES
C1CCN(C1)CCCCl
InChI
InChI=1S/C7H14ClN/c8-4-3-7-9-5-1-2-6-9/h1-7H2
InChIKey
SPRTXTPFQKHSBG-UHFFFAOYSA-N
Compound name
1-(3-chloropropyl)pyrrolidine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

864
Patents

147.08148 Da
Monoisotopic Mass

1.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 148.08876 132.8
[M+Na]+ 170.07070 139.6
[M-H]- 146.07420 133.9
[M+NH4]+ 165.11530 155.2
[M+K]+ 186.04464 136.9
[M+H-H2O]+ 130.07874 127.1
[M+HCOO]- 192.07968 149.7
[M+CH3COO]- 206.09533 172.9
[M+Na-2H]- 168.05615 136.9
[M]+ 147.08093 131.9
[M]- 147.08203 131.9
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe