CID 6507160

Phoxim, ethyl phosphonate

Structural Information

Molecular Formula
C12H15N2O3P
SMILES
CCOP(=O)(CC)O/N=C(/C#N)\C1=CC=CC=C1
InChI
InChI=1S/C12H15N2O3P/c1-3-16-18(15,4-2)17-14-12(10-13)11-8-6-5-7-9-11/h5-9H,3-4H2,1-2H3/b14-12-
InChIKey
FQRWFQURESEDEY-OWBHPGMISA-N
Compound name
(E)-N-[ethoxy(ethyl)phosphoryl]oxybenzenecarboximidoyl cyanide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

266.08203 Da
Monoisotopic Mass

3.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 267.08931 162.5
[M+Na]+ 289.07125 171.6
[M+NH4]+ 284.11585 165.1
[M+K]+ 305.04519 163.4
[M-H]- 265.07475 155.7
[M+Na-2H]- 287.05670 164.7
[M]+ 266.08148 160.8
[M]- 266.08258 160.8
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.