CID 9588613

84748-01-6

Structural Information

Molecular Formula

C₁₁H₁₂N₂O₂

SMILES

CCC1=C(OC2=CC=CC=C21)/C(=N\O)/N

InChI

InChI=1S/C11H12N2O2/c1-2-7-8-5-3-4-6-9(8)15-10(7)11(12)13-14/h3-6,14H,2H2,1H3,(H2,12,13)

InChIKey

QZCFVHVWQOHXHZ-UHFFFAOYSA-N

Compound name

3-ethyl-N'-hydroxy-1-benzofuran-2-carboximidamide

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 0
Patents: 204.08987 Da
Monoisotopic Mass: 2.6
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]+	205.097146	142.8
[M+Na]+	227.079088	151.9
[M-H]-	203.082594	148.4
[M+NH4]+	222.123693	163.0
[M+K]+	243.053028	150.1
[M+H-H2O]+	187.087130	136.8
[M+HCOO]-	249.088071	168.9
[M+CH3COO]-	263.103721	189.5
[M+Na-2H]-	225.064536	149.6
[M]+	204.08932142	144.8
[M]-	204.09041858	144.8

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.