CID 357109

Nsc614994

Structural Information

Molecular Formula
C14H19N3
SMILES
C1C2CC3C4C1C5CC(C4)(CC3C5C2)N=[N+]=[N-]
InChI
InChI=1S/C14H19N3/c15-17-16-14-4-11-8-1-7-2-9(11)13(6-14)10(3-7)12(8)5-14/h7-13H,1-6H2
InChIKey
WGSWUQPIDSQYLO-UHFFFAOYSA-N
Compound name
4-azidopentacyclo[7.3.1.14,12.02,7.06,11]tetradecane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

2
Patents

229.1579 Da
Monoisotopic Mass

4.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 230.16518 132.1
[M+Na]+ 252.14712 129.3
[M-H]- 228.15062 128.3
[M+NH4]+ 247.19172 157.0
[M+K]+ 268.12106 121.9
[M+H-H2O]+ 212.15516 125.1
[M+HCOO]- 274.15610 137.5
[M+CH3COO]- 288.17175 211.3
[M+Na-2H]- 250.13257 146.8
[M]+ 229.15735 128.2
[M]- 229.15845 128.2
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