CID 35608

Trichloroethanimidamide hydrochloride

Structural Information

Molecular Formula
C2H3Cl3N2
SMILES
C(=N)(C(Cl)(Cl)Cl)N
InChI
InChI=1S/C2H3Cl3N2/c3-2(4,5)1(6)7/h(H3,6,7)
InChIKey
FJKHRICFMSYVFL-UHFFFAOYSA-N
Compound name
2,2,2-trichloroethanimidamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

131
Patents

159.93619 Da
Monoisotopic Mass

1.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 160.94347 129.3
[M+Na]+ 182.92541 137.8
[M-H]- 158.92891 128.0
[M+NH4]+ 177.97001 150.2
[M+K]+ 198.89935 133.2
[M+H-H2O]+ 142.93345 127.9
[M+HCOO]- 204.93439 138.3
[M+CH3COO]- 218.95004 178.2
[M+Na-2H]- 180.91086 134.3
[M]+ 159.93564 127.0
[M]- 159.93674 127.0
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