CID 53769160

4-azatricyclo[5.2.2.0,2,6]undecane hydrochloride

Structural Information

Molecular Formula
C10H17N
SMILES
C1CC2CCC1C3C2CNC3
InChI
InChI=1S/C10H17N/c1-2-8-4-3-7(1)9-5-11-6-10(8)9/h7-11H,1-6H2
InChIKey
WRVOPOWJCLQYKA-UHFFFAOYSA-N
Compound name
4-azatricyclo[5.2.2.02,6]undecane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

6
Patents

151.1361 Da
Monoisotopic Mass

2.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 152.14338 130.8
[M+Na]+ 174.12532 134.1
[M-H]- 150.12882 127.1
[M+NH4]+ 169.16992 156.2
[M+K]+ 190.09926 130.6
[M+H-H2O]+ 134.13336 125.5
[M+HCOO]- 196.13430 140.2
[M+CH3COO]- 210.14995 141.1
[M+Na-2H]- 172.11077 138.8
[M]+ 151.13555 126.4
[M]- 151.13665 126.4
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