CID 12440780

1-(2-bromoethyl)pyrrolidine hydrobromide

Structural Information

Molecular Formula
C6H12BrN
SMILES
C1CCN(C1)CCBr
InChI
InChI=1S/C6H12BrN/c7-3-6-8-4-1-2-5-8/h1-6H2
InChIKey
SAVGSSSLZPLNLG-UHFFFAOYSA-N
Compound name
1-(2-bromoethyl)pyrrolidine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

258
Patents

177.0153 Da
Monoisotopic Mass

1.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 178.02258 134.3
[M+Na]+ 200.00452 144.5
[M-H]- 176.00802 138.7
[M+NH4]+ 195.04912 158.3
[M+K]+ 215.97846 135.0
[M+H-H2O]+ 160.01256 134.4
[M+HCOO]- 222.01350 154.1
[M+CH3COO]- 236.02915 177.0
[M+Na-2H]- 197.98997 140.7
[M]+ 177.01475 150.2
[M]- 177.01585 150.2
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

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