CID 13034044

1-(3-bromopropyl)pyrrolidine hydrobromide

Structural Information

Molecular Formula
C7H14BrN
SMILES
C1CCN(C1)CCCBr
InChI
InChI=1S/C7H14BrN/c8-4-3-7-9-5-1-2-6-9/h1-7H2
InChIKey
KLJFMOLCQITNEG-UHFFFAOYSA-N
Compound name
1-(3-bromopropyl)pyrrolidine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

130
Patents

191.03096 Da
Monoisotopic Mass

1.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 192.038236 138.9
[M+Na]+ 214.020178 148.7
[M-H]- 190.023684 143.1
[M+NH4]+ 209.064783 162.4
[M+K]+ 229.994118 138.9
[M+H-H2O]+ 174.028220 138.8
[M+HCOO]- 236.029161 158.4
[M+CH3COO]- 250.044811 179.8
[M+Na-2H]- 212.005626 144.7
[M]+ 191.03041142 155.1
[M]- 191.03150858 155.1
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