CID 86691758

3-bromo-2,2-dimethylpropan-1-amine hydrobromide

Structural Information

Molecular Formula
C5H12BrN
SMILES
CC(C)(CN)CBr
InChI
InChI=1S/C5H12BrN/c1-5(2,3-6)4-7/h3-4,7H2,1-2H3
InChIKey
IMDOFJMATWJHOX-UHFFFAOYSA-N
Compound name
3-bromo-2,2-dimethylpropan-1-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

49
Patents

165.0153 Da
Monoisotopic Mass

1.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 166.022576 131.0
[M+Na]+ 188.004518 141.6
[M-H]- 164.008024 133.7
[M+NH4]+ 183.049123 154.7
[M+K]+ 203.978458 131.3
[M+H-H2O]+ 148.012560 131.7
[M+HCOO]- 210.013501 151.3
[M+CH3COO]- 224.029151 179.4
[M+Na-2H]- 185.989966 139.0
[M]+ 165.01475142 147.8
[M]- 165.01584858 147.8
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