CID 81148238

2-(5-bromothiophen-3-yl)pyrrolidinehydrochloride

Structural Information

Molecular Formula
C8H10BrNS
SMILES
C1CC(NC1)C2=CSC(=C2)Br
InChI
InChI=1S/C8H10BrNS/c9-8-4-6(5-11-8)7-2-1-3-10-7/h4-5,7,10H,1-3H2
InChIKey
XOGXBHWAVZMOLT-UHFFFAOYSA-N
Compound name
2-(5-bromothiophen-3-yl)pyrrolidine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

230.97173 Da
Monoisotopic Mass

2.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 231.97901 141.4
[M+Na]+ 253.96095 142.5
[M+NH4]+ 249.00555 147.3
[M+K]+ 269.93489 143.7
[M-H]- 229.96445 142.5
[M+Na-2H]- 251.94640 143.6
[M]+ 230.97118 140.9
[M]- 230.97228 140.9
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.