CID 72060

Pheneturide

Structural Information

Molecular Formula

C₁₁H₁₄N₂O₂

SMILES

CCC(C1=CC=CC=C1)C(=O)NC(=O)N

InChI

InChI=1S/C11H14N2O2/c1-2-9(10(14)13-11(12)15)8-6-4-3-5-7-8/h3-7,9H,2H2,1H3,(H3,12,13,14,15)

InChIKey

AJOQSQHYDOFIOX-UHFFFAOYSA-N

Compound name

N-carbamoyl-2-phenylbutanamide

Related CIDs

2D Structure

compound 2d structure

5
Annotation Hits: 28
References: 3118
Patents: 206.10553 Da
Monoisotopic Mass: 1.8
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]+	207.11281	147.5
[M+Na]+	229.09475	156.2
[M+NH4]+	224.13935	154.1
[M+K]+	245.06869	152.0
[M-H]-	205.09825	148.9
[M+Na-2H]-	227.08020	152.2
[M]+	206.10498	148.6
[M]-	206.10608	148.6

Literature stripe

literature stripe

Patent stripe

patents stripe