CID 145913165

(e)-n'-(5-cyano-1-methyl-1h-imidazol-4-yl)-n,n-dimethylethanimidamide

Structural Information

Molecular Formula
C9H13N5
SMILES
C/C(=N\C1=C(N(C=N1)C)C#N)/N(C)C
InChI
InChI=1S/C9H13N5/c1-7(13(2)3)12-9-8(5-10)14(4)6-11-9/h6H,1-4H3/b12-7+
InChIKey
MCYMUEQWDXYEFR-KPKJPENVSA-N
Compound name
N'-(5-cyano-1-methylimidazol-4-yl)-N,N-dimethylethanimidamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

191.1171 Da
Monoisotopic Mass

0.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 192.12438 142.1
[M+Na]+ 214.10632 151.1
[M-H]- 190.10982 145.0
[M+NH4]+ 209.15092 159.4
[M+K]+ 230.08026 151.0
[M+H-H2O]+ 174.11436 126.8
[M+HCOO]- 236.11530 163.6
[M+CH3COO]- 250.13095 205.7
[M+Na-2H]- 212.09177 145.3
[M]+ 191.11655 138.8
[M]- 191.11765 138.8
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.