CID 227052

Dibenzyl phosphoramidate

Structural Information

Molecular Formula
C14H16NO3P
SMILES
C1=CC=C(C=C1)COP(=O)(N)OCC2=CC=CC=C2
InChI
InChI=1S/C14H16NO3P/c15-19(16,17-11-13-7-3-1-4-8-13)18-12-14-9-5-2-6-10-14/h1-10H,11-12H2,(H2,15,16)
InChIKey
HSNUXDIQZKIQRR-UHFFFAOYSA-N
Compound name
[amino(phenylmethoxy)phosphoryl]oxymethylbenzene
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

5567
Patents

277.0868 Da
Monoisotopic Mass

1.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 278.09408 163.9
[M+Na]+ 300.07602 169.3
[M-H]- 276.07952 168.4
[M+NH4]+ 295.12062 179.2
[M+K]+ 316.04996 166.5
[M+H-H2O]+ 260.08406 153.6
[M+HCOO]- 322.08500 192.8
[M+CH3COO]- 336.10065 199.0
[M+Na-2H]- 298.06147 167.9
[M]+ 277.08625 165.3
[M]- 277.08735 165.3
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