CID 239233

6300-95-4

Structural Information

Molecular Formula

C₁₀H₁₀N₂O₂

SMILES

C1C(NC(=O)NC1=O)C2=CC=CC=C2

InChI

InChI=1S/C10H10N2O2/c13-9-6-8(11-10(14)12-9)7-4-2-1-3-5-7/h1-5,8H,6H2,(H2,11,12,13,14)

InChIKey

GTYVCYXIFVPPIP-UHFFFAOYSA-N

Compound name

6-phenyl-1,3-diazinane-2,4-dione

Related CIDs

2D Structure

compound 2d structure

2
Annotation Hits: 6
References: 23
Patents: 190.07423 Da
Monoisotopic Mass: 0.4
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]+	191.08151	141.8
[M+Na]+	213.06345	154.1
[M+NH4]+	208.10805	148.8
[M+K]+	229.03739	148.2
[M-H]-	189.06695	143.3
[M+Na-2H]-	211.04890	148.1
[M]+	190.07368	143.6
[M]-	190.07478	143.6

Literature stripe

literature stripe

Patent stripe

patents stripe