CID 384840

Nsc675358

Structural Information

Molecular Formula
C10H15N7O4
SMILES
CNC(=O)OCC1=C(N(C(=N1)N=[N+]=[N-])C)COC(=O)NC
InChI
InChI=1S/C10H15N7O4/c1-12-9(18)20-4-6-7(5-21-10(19)13-2)17(3)8(14-6)15-16-11/h4-5H2,1-3H3,(H,12,18)(H,13,19)
InChIKey
VIKJORKRPAFSOV-UHFFFAOYSA-N
Compound name
[2-azido-1-methyl-5-(methylcarbamoyloxymethyl)imidazol-4-yl]methyl N-methylcarbamate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

297.11856 Da
Monoisotopic Mass

0.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 298.12584 162.4
[M+Na]+ 320.10778 168.1
[M-H]- 296.11128 166.9
[M+NH4]+ 315.15238 176.3
[M+K]+ 336.08172 163.6
[M+H-H2O]+ 280.11582 157.4
[M+HCOO]- 342.11676 192.6
[M+CH3COO]- 356.13241 208.2
[M+Na-2H]- 318.09323 169.7
[M]+ 297.11801 163.7
[M]- 297.11911 163.7
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.