CID 4112252

Refchem:469809

Structural Information

Molecular Formula

C₂H₅ClN₂O

SMILES

C(C(=NO)N)Cl

InChI

InChI=1S/C2H5ClN2O/c3-1-2(4)5-6/h6H,1H2,(H2,4,5)

InChIKey

XCARGDPHZYJCMU-UHFFFAOYSA-N

Compound name

2-chloro-N'-hydroxyethanimidamide

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 372
Patents: 108.00904 Da
Monoisotopic Mass: 0.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Å²) per adduct calculated using CCSbase.
Adduct	m/z	Predicted CCS (Å²)
[M+H]+	109.01632	117.6
[M+Na]+	130.99826	125.6
[M-H]-	107.00176	117.8
[M+NH4]+	126.04286	140.4
[M+K]+	146.97220	124.0
[M+H-H2O]+	91.006300	114.0
[M+HCOO]-	153.00724	138.9
[M+CH3COO]-	167.02289	169.1
[M+Na-2H]-	128.98371	124.2
[M]+	108.00849	116.4
[M]-	108.00959	116.4

Literature stripe

literature stripe

Patent stripe

patents stripe