CID 44152034

160370-04-7

Structural Information

Molecular Formula
C10H17N4O2
SMILES
CC1=[N+](C=CN1C(=O)N(C)C)C(=O)N(C)C
InChI
InChI=1S/C10H17N4O2/c1-8-13(9(15)11(2)3)6-7-14(8)10(16)12(4)5/h6-7H,1-5H3/q+1
InChIKey
SXXNTJLRPDMISD-UHFFFAOYSA-N
Compound name
1-N,1-N,3-N,3-N,2-pentamethylimidazol-1-ium-1,3-dicarboxamide
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

0
Patents

225.13515 Da
Monoisotopic Mass

0.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 226.14243 149.6
[M+Na]+ 248.12437 157.1
[M-H]- 224.12787 154.6
[M+NH4]+ 243.16897 167.9
[M+K]+ 264.09831 153.1
[M+H-H2O]+ 208.13241 144.7
[M+HCOO]- 270.13335 173.8
[M+CH3COO]- 284.14900 192.8
[M+Na-2H]- 246.10982 153.5
[M]+ 225.13460 151.8
[M]- 225.13570 151.8
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.