CID 3077852

135756-61-5

Structural Information

Molecular Formula

C₉H₁₅N₄O₂

SMILES

CN(C)C(=O)N1C=C[N+](=C1)C(=O)N(C)C

InChI

InChI=1S/C9H15N4O2/c1-10(2)8(14)12-5-6-13(7-12)9(15)11(3)4/h5-7H,1-4H3/q+1

InChIKey

RNWYCOQITSHEBG-UHFFFAOYSA-N

Compound name

1-N,1-N,3-N,3-N-tetramethylimidazol-1-ium-1,3-dicarboxamide

Related CIDs

2D Structure

compound 2d structure

2
Annotation Hits: 0
References: 6
Patents: 211.1195 Da
Monoisotopic Mass: -0.1
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]+	212.12678	144.4
[M+Na]+	234.10872	154.6
[M+NH4]+	229.15332	151.3
[M+K]+	250.08266	154.5
[M-H]-	210.11222	146.1
[M+Na-2H]-	232.09417	149.3
[M]+	211.11895	146.2
[M]-	211.12005	146.2

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe