CID 417466

5-bromopentan-1-amine hydrobromide

Structural Information

Molecular Formula
C5H12BrN
SMILES
C(CCN)CCBr
InChI
InChI=1S/C5H12BrN/c6-4-2-1-3-5-7/h1-5,7H2
InChIKey
HYMLYXZEQWBTBE-UHFFFAOYSA-N
Compound name
5-bromopentan-1-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

147
Patents

165.0153 Da
Monoisotopic Mass

1.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 166.02258 129.8
[M+Na]+ 188.00452 140.0
[M-H]- 164.00802 132.2
[M+NH4]+ 183.04912 153.4
[M+K]+ 203.97846 129.5
[M+H-H2O]+ 148.01256 130.0
[M+HCOO]- 210.01350 151.6
[M+CH3COO]- 224.02915 179.2
[M+Na-2H]- 185.98997 137.4
[M]+ 165.01475 147.1
[M]- 165.01585 147.1
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