CID 96688

18228-87-0

Structural Information

Molecular Formula
C8H19Cl2N2O3P
SMILES
CCOP(=O)(NCCO)N(CCCl)CCCl
InChI
InChI=1S/C8H19Cl2N2O3P/c1-2-15-16(14,11-5-8-13)12(6-3-9)7-4-10/h13H,2-8H2,1H3,(H,11,14)
InChIKey
XTQZDKCCPAUKDV-UHFFFAOYSA-N
Compound name
2-[[bis(2-chloroethyl)amino-ethoxyphosphoryl]amino]ethanol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

292.05103 Da
Monoisotopic Mass

0.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 293.05831 162.5
[M+Na]+ 315.04025 169.5
[M+NH4]+ 310.08485 167.9
[M+K]+ 331.01419 165.0
[M-H]- 291.04375 160.2
[M+Na-2H]- 313.02570 163.7
[M]+ 292.05048 162.9
[M]- 292.05158 162.9
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.