CID 75481226

4-(3-azidopropyl)-4-methylmorpholin-4-ium iodide

Structural Information

Molecular Formula
C8H17N4O
SMILES
C[N+]1(CCOCC1)CCCN=[N+]=[N-]
InChI
InChI=1S/C8H17N4O/c1-12(4-2-3-10-11-9)5-7-13-8-6-12/h2-8H2,1H3/q+1
InChIKey
HWHLYKFJSMXPDY-UHFFFAOYSA-N
Compound name
4-(3-azidopropyl)-4-methylmorpholin-4-ium
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

185.14024 Da
Monoisotopic Mass

1.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 186.14752 137.7
[M+Na]+ 208.12946 141.7
[M-H]- 184.13296 142.3
[M+NH4]+ 203.17406 156.2
[M+K]+ 224.10340 132.7
[M+H-H2O]+ 168.13750 137.9
[M+HCOO]- 230.13844 162.2
[M+CH3COO]- 244.15409 178.1
[M+Na-2H]- 206.11491 151.3
[M]+ 185.13969 132.1
[M]- 185.14079 132.1
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.