CID 11971118

93316-43-9

Structural Information

Molecular Formula

C₁₇H₁₅NO₃

SMILES

CN1C(=O)C(COC1=O)(C2=CC=CC=C2)C3=CC=CC=C3

InChI

InChI=1S/C17H15NO3/c1-18-15(19)17(12-21-16(18)20,13-8-4-2-5-9-13)14-10-6-3-7-11-14/h2-11H,12H2,1H3

InChIKey

UZAWIYPLXCOWTE-UHFFFAOYSA-N

Compound name

3-methyl-5,5-diphenyl-1,3-oxazinane-2,4-dione

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 1
Patents: 281.1052 Da
Monoisotopic Mass: 2.8
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]+	282.112476	163.9
[M+Na]+	304.094418	171.8
[M-H]-	280.097924	173.0
[M+NH4]+	299.139023	178.5
[M+K]+	320.068358	169.0
[M+H-H2O]+	264.102460	154.5
[M+HCOO]-	326.103401	183.0
[M+CH3COO]-	340.119051	175.7
[M+Na-2H]-	302.079866	169.4
[M]+	281.10465142	162.5
[M]-	281.10574858	162.5

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe