CID 19851629

Benzoylphenylurea

Structural Information

Molecular Formula

C₁₄H₁₂N₂O₂

SMILES

C1=CC=C(C=C1)C(=O)N(C2=CC=CC=C2)C(=O)N

InChI

InChI=1S/C14H12N2O2/c15-14(18)16(12-9-5-2-6-10-12)13(17)11-7-3-1-4-8-11/h1-10H,(H2,15,18)

InChIKey

XYFMGGWVGACNEC-UHFFFAOYSA-N

Compound name

N-carbamoyl-N-phenylbenzamide

Related CIDs

2D Structure

compound 2d structure

2
Annotation Hits: 50
References: 2204
Patents: 240.08987 Da
Monoisotopic Mass: 2.7
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]+	241.09715	153.7
[M+Na]+	263.07909	158.7
[M-H]-	239.08259	161.0
[M+NH4]+	258.12369	170.1
[M+K]+	279.05303	156.7
[M+H-H2O]+	223.08713	145.4
[M+HCOO]-	285.08807	178.8
[M+CH3COO]-	299.10372	197.5
[M+Na-2H]-	261.06454	158.2
[M]+	240.08932	151.6
[M]-	240.09042	151.6

Literature stripe

literature stripe

Patent stripe

patents stripe