CID 9574607

[1-aza-2-(3,4dichlorophenyl)vinyl](imino-4-pyridylmethyl)amine

Structural Information

Molecular Formula
C13H10Cl2N4
SMILES
C1=CC(=C(C=C1/C=N/N=C(/C2=CC=NC=C2)\N)Cl)Cl
InChI
InChI=1S/C13H10Cl2N4/c14-11-2-1-9(7-12(11)15)8-18-19-13(16)10-3-5-17-6-4-10/h1-8H,(H2,16,19)/b18-8+
InChIKey
URQDDLJZONWEQD-QGMBQPNBSA-N
Compound name
N'-[(E)-(3,4-dichlorophenyl)methylideneamino]pyridine-4-carboximidamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

292.02826 Da
Monoisotopic Mass

2.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 293.03554 165.5
[M+Na]+ 315.01748 174.3
[M-H]- 291.02098 172.2
[M+NH4]+ 310.06208 181.0
[M+K]+ 330.99142 167.9
[M+H-H2O]+ 275.02552 157.5
[M+HCOO]- 337.02646 183.8
[M+CH3COO]- 351.04211 209.0
[M+Na-2H]- 313.00293 170.9
[M]+ 292.02771 167.5
[M]- 292.02881 167.5
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.