CID 138039786

2241130-18-5

Structural Information

Molecular Formula
C8H14N4
SMILES
C1CC2CC(CC(C1)N2)N=[N+]=[N-]
InChI
InChI=1S/C8H14N4/c9-12-11-8-4-6-2-1-3-7(5-8)10-6/h6-8,10H,1-5H2
InChIKey
NOOUZWQNFVDCFF-UHFFFAOYSA-N
Compound name
3-azido-9-azabicyclo[3.3.1]nonane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

166.12184 Da
Monoisotopic Mass

2.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 167.12912 130.3
[M+Na]+ 189.11106 133.8
[M-H]- 165.11456 132.0
[M+NH4]+ 184.15566 150.2
[M+K]+ 205.08500 127.4
[M+H-H2O]+ 149.11910 128.0
[M+HCOO]- 211.12004 151.8
[M+CH3COO]- 225.13569 179.8
[M+Na-2H]- 187.09651 141.2
[M]+ 166.12129 120.7
[M]- 166.12239 120.7
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

No patent data available for this compound.