CID 205558

18183-53-4

Structural Information

Molecular Formula
C10H19Cl3NO4P
SMILES
CCCCOP(=O)(NC(=O)C(Cl)(Cl)Cl)OCCCC
InChI
InChI=1S/C10H19Cl3NO4P/c1-3-5-7-17-19(16,18-8-6-4-2)14-9(15)10(11,12)13/h3-8H2,1-2H3,(H,14,15,16)
InChIKey
FGWVWHHVAIIXGY-UHFFFAOYSA-N
Compound name
2,2,2-trichloro-N-dibutoxyphosphorylacetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

353.01172 Da
Monoisotopic Mass

3.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 354.01900 174.5
[M+Na]+ 376.00094 182.0
[M+NH4]+ 371.04554 178.9
[M+K]+ 391.97488 177.6
[M-H]- 352.00444 170.4
[M+Na-2H]- 373.98639 174.9
[M]+ 353.01117 174.8
[M]- 353.01227 174.8
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.