CID 13239288

Bicyclo[2.2.2]octan-2-amine hydrochloride

Structural Information

Molecular Formula
C8H15N
SMILES
C1CC2CCC1CC2N
InChI
InChI=1S/C8H15N/c9-8-5-6-1-3-7(8)4-2-6/h6-8H,1-5,9H2
InChIKey
MCLJDHWIDXKUBS-UHFFFAOYSA-N
Compound name
bicyclo[2.2.2]octan-2-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

197
Patents

125.12045 Da
Monoisotopic Mass

1.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 126.127726 125.1
[M+Na]+ 148.109668 129.0
[M-H]- 124.113174 121.5
[M+NH4]+ 143.154273 151.3
[M+K]+ 164.083608 127.0
[M+H-H2O]+ 108.117710 121.3
[M+HCOO]- 170.118651 138.0
[M+CH3COO]- 184.134301 136.4
[M+Na-2H]- 146.095116 136.3
[M]+ 125.11990142 122.3
[M]- 125.12099858 122.3
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe