CID 213166

25646-22-4

Structural Information

Molecular Formula
C7H11Cl3NO3P
SMILES
C=CCNP(=O)(OCCCl)OC=C(Cl)Cl
InChI
InChI=1S/C7H11Cl3NO3P/c1-2-4-11-15(12,13-5-3-8)14-6-7(9)10/h2,6H,1,3-5H2,(H,11,12)
InChIKey
WNFBQMBSZZCOJJ-UHFFFAOYSA-N
Compound name
N-[2-chloroethoxy(2,2-dichloroethenoxy)phosphoryl]prop-2-en-1-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

292.95422 Da
Monoisotopic Mass

2.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 293.96150 156.9
[M+Na]+ 315.94344 164.9
[M-H]- 291.94694 155.1
[M+NH4]+ 310.98804 174.1
[M+K]+ 331.91738 159.4
[M+H-H2O]+ 275.95148 152.8
[M+HCOO]- 337.95242 170.5
[M+CH3COO]- 351.96807 199.1
[M+Na-2H]- 313.92889 158.2
[M]+ 292.95367 163.1
[M]- 292.95477 163.1
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.