CID 10351653

Bicyclo[1.1.1]pentan-2-amine hydrochloride

Structural Information

Molecular Formula
C5H9N
SMILES
C1C2CC1C2N
InChI
InChI=1S/C5H9N/c6-5-3-1-4(5)2-3/h3-5H,1-2,6H2
InChIKey
TWFDMMFLHVFKHH-UHFFFAOYSA-N
Compound name
bicyclo[1.1.1]pentan-2-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

87
Patents

83.0735 Da
Monoisotopic Mass

0.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 84.080776 127.2
[M+Na]+ 106.062718 131.2
[M-H]- 82.066224 130.2
[M+NH4]+ 101.107323 133.3
[M+K]+ 122.036658 138.2
[M+H-H2O]+ 66.070760 112.5
[M+HCOO]- 128.071701 141.9
[M+CH3COO]- 142.087351 199.5
[M+Na-2H]- 104.048166 134.1
[M]+ 83.07295142 149.7
[M]- 83.07404858 149.7
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

patents stripe