CID 55271649

2-(3-chlorothiophen-2-yl)pyrrolidine

Structural Information

Molecular Formula
C8H10ClNS
SMILES
C1CC(NC1)C2=C(C=CS2)Cl
InChI
InChI=1S/C8H10ClNS/c9-6-3-5-11-8(6)7-2-1-4-10-7/h3,5,7,10H,1-2,4H2
InChIKey
VWFUUDCALRFEGJ-UHFFFAOYSA-N
Compound name
2-(3-chlorothiophen-2-yl)pyrrolidine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

187.02225 Da
Monoisotopic Mass

2.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 188.02953 138.2
[M+Na]+ 210.01147 149.3
[M+NH4]+ 205.05607 148.4
[M+K]+ 225.98541 143.7
[M-H]- 186.01497 141.1
[M+Na-2H]- 207.99692 143.6
[M]+ 187.02170 141.2
[M]- 187.02280 141.2
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.