CID 15561337

2-(3-chlorophenoxy)ethanimidamide hydrochloride

Structural Information

Molecular Formula
C8H9ClN2O
SMILES
C1=CC(=CC(=C1)Cl)OCC(=N)N
InChI
InChI=1S/C8H9ClN2O/c9-6-2-1-3-7(4-6)12-5-8(10)11/h1-4H,5H2,(H3,10,11)
InChIKey
GQIZPSYLKHRSNS-UHFFFAOYSA-N
Compound name
2-(3-chlorophenoxy)ethanimidamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

11
Patents

184.04034 Da
Monoisotopic Mass

1.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 185.047616 136.9
[M+Na]+ 207.029558 144.7
[M-H]- 183.033064 140.1
[M+NH4]+ 202.074163 156.7
[M+K]+ 223.003498 140.9
[M+H-H2O]+ 167.037600 131.7
[M+HCOO]- 229.038541 158.0
[M+CH3COO]- 243.054191 184.3
[M+Na-2H]- 205.015006 142.6
[M]+ 184.03979142 136.4
[M]- 184.04088858 136.4
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