CID 118903

36031-66-0

Structural Information

Molecular Formula
C8H10Cl2NO3P
SMILES
CCNP(=O)(O)OC1=C(C=C(C=C1)Cl)Cl
InChI
InChI=1S/C8H10Cl2NO3P/c1-2-11-15(12,13)14-8-4-3-6(9)5-7(8)10/h3-5H,2H2,1H3,(H2,11,12,13)
InChIKey
GBLGCYMBEGBLRD-UHFFFAOYSA-N
Compound name
(2,4-dichlorophenoxy)-N-ethylphosphonamidic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

268.97754 Da
Monoisotopic Mass

2.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 269.98482 151.6
[M+Na]+ 291.96676 161.3
[M-H]- 267.97026 153.1
[M+NH4]+ 287.01136 169.5
[M+K]+ 307.94070 156.5
[M+H-H2O]+ 251.97480 146.0
[M+HCOO]- 313.97574 170.8
[M+CH3COO]- 327.99139 193.9
[M+Na-2H]- 289.95221 154.9
[M]+ 268.97699 156.9
[M]- 268.97809 156.9
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.