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

142
Patents

191.03096 Da
Monoisotopic Mass

1.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 192.03824 138.9
[M+Na]+ 214.02018 148.7
[M-H]- 190.02368 143.1
[M+NH4]+ 209.06478 162.4
[M+K]+ 229.99412 138.9
[M+H-H2O]+ 174.02822 138.8
[M+HCOO]- 236.02916 158.4
[M+CH3COO]- 250.04481 179.8
[M+Na-2H]- 212.00563 144.7
[M]+ 191.03041 155.1
[M]- 191.03151 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