CID 135400515

19208-69-6

Structural Information

Molecular Formula
C18H20N3O4P
SMILES
CN\1CC(=O)N/C1=N\P(=O)(OCC2=CC=CC=C2)OCC3=CC=CC=C3
InChI
InChI=1S/C18H20N3O4P/c1-21-12-17(22)19-18(21)20-26(23,24-13-15-8-4-2-5-9-15)25-14-16-10-6-3-7-11-16/h2-11H,12-14H2,1H3,(H,19,20,22,23)
InChIKey
FFEFFWWQHCAWCF-UHFFFAOYSA-N
Compound name
(2E)-2-bis(phenylmethoxy)phosphorylimino-1-methylimidazolidin-4-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

2
References

1
Patents

373.11914 Da
Monoisotopic Mass

1.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 374.12642 185.1
[M+Na]+ 396.10836 189.3
[M-H]- 372.11186 190.4
[M+NH4]+ 391.15296 195.3
[M+K]+ 412.08230 185.7
[M+H-H2O]+ 356.11640 172.3
[M+HCOO]- 418.11734 210.2
[M+CH3COO]- 432.13299 215.7
[M+Na-2H]- 394.09381 185.3
[M]+ 373.11859 185.2
[M]- 373.11969 185.2
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.