CID 11971108

L 1806

Structural Information

Molecular Formula
C16H13NO3
SMILES
C1C(C(=O)NC(=O)O1)(C2=CC=CC=C2)C3=CC=CC=C3
InChI
InChI=1S/C16H13NO3/c18-14-16(11-20-15(19)17-14,12-7-3-1-4-8-12)13-9-5-2-6-10-13/h1-10H,11H2,(H,17,18,19)
InChIKey
SFVHAWHYIKYZME-UHFFFAOYSA-N
Compound name
5,5-diphenyl-1,3-oxazinane-2,4-dione
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

1
Patents

267.08954 Da
Monoisotopic Mass

2.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 268.09682 160.3
[M+Na]+ 290.07876 167.3
[M-H]- 266.08226 167.8
[M+NH4]+ 285.12336 174.5
[M+K]+ 306.05270 163.7
[M+H-H2O]+ 250.08680 151.3
[M+HCOO]- 312.08774 178.3
[M+CH3COO]- 326.10339 171.5
[M+Na-2H]- 288.06421 166.6
[M]+ 267.08899 156.4
[M]- 267.09009 156.4
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe