CID 591591

40067-82-1

Structural Information

Molecular Formula

C₈H₁₀N₂O

SMILES

CC1=CC(=CC=C1)C(=NO)N

InChI

InChI=1S/C8H10N2O/c1-6-3-2-4-7(5-6)8(9)10-11/h2-5,11H,1H3,(H2,9,10)

InChIKey

KJMNPGUHEUTHMR-UHFFFAOYSA-N

Compound name

N'-hydroxy-3-methylbenzenecarboximidamide

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 1
References: 392
Patents: 150.07932 Da
Monoisotopic Mass: 1.4
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]+	151.08660	130.2
[M+Na]+	173.06854	137.4
[M-H]-	149.07204	133.8
[M+NH4]+	168.11314	150.8
[M+K]+	189.04248	135.7
[M+H-H2O]+	133.07658	124.3
[M+HCOO]-	195.07752	156.0
[M+CH3COO]-	209.09317	179.8
[M+Na-2H]-	171.05399	136.5
[M]+	150.07877	127.6
[M]-	150.07987	127.6

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe