CID 9589073

1-(phenylmethyl)-1h-imidazole-2-carboxaldehyde dimethylhydrazone monohydrochloride

Structural Information

Molecular Formula
C13H16N4
SMILES
CN(C)/N=C/C1=NC=CN1CC2=CC=CC=C2
InChI
InChI=1S/C13H16N4/c1-16(2)15-10-13-14-8-9-17(13)11-12-6-4-3-5-7-12/h3-10H,11H2,1-2H3/b15-10+
InChIKey
RKNGLCCQKGAXAT-XNTDXEJSSA-N
Compound name
N-[(E)-(1-benzylimidazol-2-yl)methylideneamino]-N-methylmethanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

228.1375 Da
Monoisotopic Mass

2.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 229.14478 151.8
[M+Na]+ 251.12672 158.8
[M-H]- 227.13022 158.6
[M+NH4]+ 246.17132 169.5
[M+K]+ 267.10066 156.6
[M+H-H2O]+ 211.13476 142.0
[M+HCOO]- 273.13570 178.9
[M+CH3COO]- 287.15135 199.7
[M+Na-2H]- 249.11217 157.8
[M]+ 228.13695 153.6
[M]- 228.13805 153.6
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.