CID 2823825

2,4-difluorobenzamidoxime

Structural Information

Molecular Formula

C₇H₆F₂N₂O

SMILES

C1=CC(=C(C=C1F)F)C(=NO)N

InChI

InChI=1S/C7H6F2N2O/c8-4-1-2-5(6(9)3-4)7(10)11-12/h1-3,12H,(H2,10,11)

InChIKey

WFNFKOIWDXLTJB-UHFFFAOYSA-N

Compound name

2,4-difluoro-N'-hydroxybenzenecarboximidamide

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 118
Patents: 172.04482 Da
Monoisotopic Mass: 1.3
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]+	173.05210	130.4
[M+Na]+	195.03404	139.0
[M-H]-	171.03754	131.7
[M+NH4]+	190.07864	150.2
[M+K]+	211.00798	136.7
[M+H-H2O]+	155.04208	122.9
[M+HCOO]-	217.04302	154.4
[M+CH3COO]-	231.05867	183.5
[M+Na-2H]-	193.01949	135.3
[M]+	172.04427	125.5
[M]-	172.04537	125.5

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe