CID 9588644

85475-44-1

Structural Information

Molecular Formula

C₁₂H₁₃N₃O₂

SMILES

CC(/C(=N/O)/N)N1C(=O)C=CC2=CC=CC=C21

InChI

InChI=1S/C12H13N3O2/c1-8(12(13)14-17)15-10-5-3-2-4-9(10)6-7-11(15)16/h2-8,17H,1H3,(H2,13,14)

InChIKey

YKYVQADQCPMSDW-UHFFFAOYSA-N

Compound name

N'-hydroxy-2-(2-oxoquinolin-1-yl)propanimidamide

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 0
Patents: 231.10077 Da
Monoisotopic Mass: 1.1
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]+	232.108046	149.4
[M+Na]+	254.089988	157.1
[M-H]-	230.093494	152.5
[M+NH4]+	249.134593	166.3
[M+K]+	270.063928	154.0
[M+H-H2O]+	214.098030	142.0
[M+HCOO]-	276.098971	171.8
[M+CH3COO]-	290.114621	195.8
[M+Na-2H]-	252.075436	155.3
[M]+	231.10022142	148.2
[M]-	231.10131858	148.2

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.