CID 11971225

L 2042

Structural Information

Molecular Formula
C18H17NO3
SMILES
CN1C(=O)C(COC1=O)(CC2=CC=CC=C2)C3=CC=CC=C3
InChI
InChI=1S/C18H17NO3/c1-19-16(20)18(13-22-17(19)21,15-10-6-3-7-11-15)12-14-8-4-2-5-9-14/h2-11H,12-13H2,1H3
InChIKey
BCINTPZPIYTVPN-UHFFFAOYSA-N
Compound name
5-benzyl-3-methyl-5-phenyl-1,3-oxazinane-2,4-dione
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

295.12085 Da
Monoisotopic Mass

3.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 296.12813 168.5
[M+Na]+ 318.11007 184.0
[M+NH4]+ 313.15467 177.8
[M+K]+ 334.08401 174.3
[M-H]- 294.11357 175.5
[M+Na-2H]- 316.09552 179.1
[M]+ 295.12030 173.0
[M]- 295.12140 173.0
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.