CID 597357

175276-76-3

Structural Information

Molecular Formula
C8H8Cl2N2
SMILES
C1=CC(=C(C(=C1)Cl)CC(=N)N)Cl
InChI
InChI=1S/C8H8Cl2N2/c9-6-2-1-3-7(10)5(6)4-8(11)12/h1-3H,4H2,(H3,11,12)
InChIKey
OXTFFPWHLJQPEE-UHFFFAOYSA-N
Compound name
2-(2,6-dichlorophenyl)ethanimidamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

3
References

117
Patents

202.00645 Da
Monoisotopic Mass

2.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 203.01373 140.9
[M+Na]+ 224.99567 150.0
[M-H]- 200.99917 143.7
[M+NH4]+ 220.04027 160.7
[M+K]+ 240.96961 144.2
[M+H-H2O]+ 185.00371 137.1
[M+HCOO]- 247.00465 156.6
[M+CH3COO]- 261.02030 188.1
[M+Na-2H]- 222.98112 144.9
[M]+ 202.00590 140.5
[M]- 202.00700 140.5
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe