CID 2756838

4-bromo-n-hydroxybenzimidamide

Structural Information

Molecular Formula

C₇H₇BrN₂O

SMILES

C1=CC(=CC=C1C(=NO)N)Br

InChI

InChI=1S/C7H7BrN2O/c8-6-3-1-5(2-4-6)7(9)10-11/h1-4,11H,(H2,9,10)

InChIKey

KCHIZOZPSSURRB-UHFFFAOYSA-N

Compound name

4-bromo-N'-hydroxybenzenecarboximidamide

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 224
Patents: 213.97418 Da
Monoisotopic Mass: 1.7
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]+	214.981456	136.1
[M+Na]+	236.963398	146.4
[M-H]-	212.966904	142.0
[M+NH4]+	232.008003	157.2
[M+K]+	252.937338	135.2
[M+H-H2O]+	196.971440	135.0
[M+HCOO]-	258.972381	159.2
[M+CH3COO]-	272.988031	187.1
[M+Na-2H]-	234.948846	143.6
[M]+	213.97363142	151.6
[M]-	213.97472858	151.6

Literature stripe

literature stripe

Patent stripe

patents stripe