CID 45098651

2-bromobicyclo[2.2.1]heptan-1-amine hydrochloride

Structural Information

Molecular Formula
C7H12BrN
SMILES
C1CC2(CC1CC2Br)N
InChI
InChI=1S/C7H12BrN/c8-6-3-5-1-2-7(6,9)4-5/h5-6H,1-4,9H2
InChIKey
TXJOHGYEKJPXRA-UHFFFAOYSA-N
Compound name
2-bromobicyclo[2.2.1]heptan-1-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

189.0153 Da
Monoisotopic Mass

1.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 190.02258 140.3
[M+Na]+ 212.00452 151.6
[M-H]- 188.00802 145.6
[M+NH4]+ 207.04912 169.6
[M+K]+ 227.97846 140.9
[M+H-H2O]+ 172.01256 142.0
[M+HCOO]- 234.01350 160.2
[M+CH3COO]- 248.02915 155.6
[M+Na-2H]- 209.98997 146.1
[M]+ 189.01475 154.8
[M]- 189.01585 154.8
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

No patent data available for this compound.