CID 10103327

3-(aminomethyl)benzamide

Structural Information

Molecular Formula

C₈H₁₀N₂O

SMILES

C1=CC(=CC(=C1)C(=O)N)CN

InChI

InChI=1S/C8H10N2O/c9-5-6-2-1-3-7(4-6)8(10)11/h1-4H,5,9H2,(H2,10,11)

InChIKey

HYHLWVJLJXARGY-UHFFFAOYSA-N

Compound name

3-(aminomethyl)benzamide

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 326
Patents: 150.07932 Da
Monoisotopic Mass: -0.3
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]+	151.08660	130.7
[M+Na]+	173.06854	141.3
[M+NH4]+	168.11314	138.8
[M+K]+	189.04248	136.2
[M-H]-	149.07204	133.4
[M+Na-2H]-	171.05399	137.0
[M]+	150.07877	132.7
[M]-	150.07987	132.7

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe