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

m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Å²) per adduct calculated using CCSbase.
Adduct	m/z	Predicted CCS (Å²)
[M+H]+	167.12912	132.6
[M+Na]+	189.11106	143.1
[M+NH4]+	184.15566	142.4
[M+K]+	205.08500	138.1
[M-H]-	165.11456	137.0
[M+Na-2H]-	187.09651	137.0
[M]+	166.12129	134.9
[M]-	166.12239	134.9

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.