CID 11971380

94673-83-3

Structural Information

Molecular Formula
C17H15NO3
SMILES
C1C(C(=O)NC(=O)O1)(CC2=CC=CC=C2)C3=CC=CC=C3
InChI
InChI=1S/C17H15NO3/c19-15-17(12-21-16(20)18-15,14-9-5-2-6-10-14)11-13-7-3-1-4-8-13/h1-10H,11-12H2,(H,18,19,20)
InChIKey
WEVKDZCYKHYUGE-UHFFFAOYSA-N
Compound name
5-benzyl-5-phenyl-1,3-oxazinane-2,4-dione
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

281.1052 Da
Monoisotopic Mass

2.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 282.112476 164.8
[M+Na]+ 304.094418 171.3
[M-H]- 280.097924 172.1
[M+NH4]+ 299.139023 178.4
[M+K]+ 320.068358 167.5
[M+H-H2O]+ 264.102460 155.5
[M+HCOO]- 326.103401 182.4
[M+CH3COO]- 340.119051 175.5
[M+Na-2H]- 302.079866 170.5
[M]+ 281.10465142 161.1
[M]- 281.10574858 161.1
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

No patent data available for this compound.