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

133
Patents

165.0153 Da
Monoisotopic Mass

1.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 166.022576 129.8
[M+Na]+ 188.004518 140.0
[M-H]- 164.008024 132.2
[M+NH4]+ 183.049123 153.4
[M+K]+ 203.978458 129.5
[M+H-H2O]+ 148.012560 130.0
[M+HCOO]- 210.013501 151.6
[M+CH3COO]- 224.029151 179.2
[M+Na-2H]- 185.989966 137.4
[M]+ 165.01475142 147.1
[M]- 165.01584858 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