CID 295254

1-(2-carbamoylphenyl)-3-phenylurea

Structural Information

Molecular Formula

C₁₄H₁₃N₃O₂

SMILES

C1=CC=C(C=C1)NC(=O)NC2=CC=CC=C2C(=O)N

InChI

InChI=1S/C14H13N3O2/c15-13(18)11-8-4-5-9-12(11)17-14(19)16-10-6-2-1-3-7-10/h1-9H,(H2,15,18)(H2,16,17,19)

InChIKey

JURFKSPPIXXOMA-UHFFFAOYSA-N

Compound name

2-(phenylcarbamoylamino)benzamide

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 5
References: 17
Patents: 255.10077 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]+	256.10805	156.6
[M+Na]+	278.08999	161.5
[M-H]-	254.09349	162.8
[M+NH4]+	273.13459	171.7
[M+K]+	294.06393	158.3
[M+H-H2O]+	238.09803	148.2
[M+HCOO]-	300.09897	182.2
[M+CH3COO]-	314.11462	200.7
[M+Na-2H]-	276.07544	161.6
[M]+	255.10022	152.9
[M]-	255.10132	152.9

Literature stripe

literature stripe

Patent stripe

patents stripe