CID 205636

Phosphine oxide, bis(2-chloroethyl)methyl-

Structural Information

Molecular Formula
C5H11Cl2OP
SMILES
CP(=O)(CCCl)CCCl
InChI
InChI=1S/C5H11Cl2OP/c1-9(8,4-2-6)5-3-7/h2-5H2,1H3
InChIKey
DTEODNBAIDDEMW-UHFFFAOYSA-N
Compound name
1-chloro-2-[2-chloroethyl(methyl)phosphoryl]ethane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

187.99246 Da
Monoisotopic Mass

0.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 188.99974 136.8
[M+Na]+ 210.98168 146.3
[M-H]- 186.98518 136.0
[M+NH4]+ 206.02628 158.8
[M+K]+ 226.95562 142.2
[M+H-H2O]+ 170.98972 132.7
[M+HCOO]- 232.99066 155.4
[M+CH3COO]- 247.00631 181.4
[M+Na-2H]- 208.96713 140.6
[M]+ 187.99191 142.4
[M]- 187.99301 142.4
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.