CID 207437

Brn 0831220

Structural Information

Molecular Formula
C18H18N2O3
SMILES
C1CN(C(=O)N(C1=O)CC2=CC=CC=C2)OCC3=CC=CC=C3
InChI
InChI=1S/C18H18N2O3/c21-17-11-12-20(23-14-16-9-5-2-6-10-16)18(22)19(17)13-15-7-3-1-4-8-15/h1-10H,11-14H2
InChIKey
CVGICVKNQNQILP-UHFFFAOYSA-N
Compound name
3-benzyl-1-phenylmethoxy-1,3-diazinane-2,4-dione
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

310.13174 Da
Monoisotopic Mass

2.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 311.13902 173.8
[M+Na]+ 333.12096 188.5
[M+NH4]+ 328.16556 180.9
[M+K]+ 349.09490 180.4
[M-H]- 309.12446 178.6
[M+Na-2H]- 331.10641 182.8
[M]+ 310.13119 177.2
[M]- 310.13229 177.2
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.