CID 267578

4-azatricyclo[5.2.1.0,2,6]decane hydrochloride

Structural Information

Molecular Formula
C9H15N
SMILES
C1CC2CC1C3C2CNC3
InChI
InChI=1S/C9H15N/c1-2-7-3-6(1)8-4-10-5-9(7)8/h6-10H,1-5H2
InChIKey
VBSDAMAWZZSZMY-UHFFFAOYSA-N
Compound name
4-azatricyclo[5.2.1.02,6]decane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

169
Patents

137.12045 Da
Monoisotopic Mass

1.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 138.12773 133.7
[M+Na]+ 160.10967 140.3
[M-H]- 136.11317 134.6
[M+NH4]+ 155.15427 161.0
[M+K]+ 176.08361 137.6
[M+H-H2O]+ 120.11771 129.2
[M+HCOO]- 182.11865 151.4
[M+CH3COO]- 196.13430 146.4
[M+Na-2H]- 158.09512 135.4
[M]+ 137.11990 128.8
[M]- 137.12100 128.8
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