CID 9589073

134221-12-8

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]+ 229.144776 151.8
[M+Na]+ 251.126718 158.8
[M-H]- 227.130224 158.6
[M+NH4]+ 246.171323 169.5
[M+K]+ 267.100658 156.6
[M+H-H2O]+ 211.134760 142.0
[M+HCOO]- 273.135701 178.9
[M+CH3COO]- 287.151351 199.7
[M+Na-2H]- 249.112166 157.8
[M]+ 228.13695142 153.6
[M]- 228.13804858 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.