CID 165941220

1-[1-(bromomethyl)cyclobutyl]methanamine hydrochloride

Structural Information

Molecular Formula
C6H12BrN
SMILES
C1CC(C1)(CN)CBr
InChI
InChI=1S/C6H12BrN/c7-4-6(5-8)2-1-3-6/h1-5,8H2
InChIKey
PRCXTRGDNRIGER-UHFFFAOYSA-N
Compound name
[1-(bromomethyl)cyclobutyl]methanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

177.0153 Da
Monoisotopic Mass

1.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 178.022576 125.5
[M+Na]+ 200.004518 134.5
[M-H]- 176.008024 131.2
[M+NH4]+ 195.049123 144.3
[M+K]+ 215.978458 127.2
[M+H-H2O]+ 160.012560 122.2
[M+HCOO]- 222.013501 145.7
[M+CH3COO]- 236.029151 182.9
[M+Na-2H]- 197.989966 134.0
[M]+ 177.01475142 148.7
[M]- 177.01584858 148.7
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

No patent data available for this compound.