CID 10630760

Ethyl (chloromethyl)(methyl)phosphinate

Structural Information

Molecular Formula
C4H10ClO2P
SMILES
CCOP(=O)(C)CCl
InChI
InChI=1S/C4H10ClO2P/c1-3-7-8(2,6)4-5/h3-4H2,1-2H3
InChIKey
TTXWIKOQNODHCO-UHFFFAOYSA-N
Compound name
1-[chloromethyl(methyl)phosphoryl]oxyethane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

12
Patents

156.0107 Da
Monoisotopic Mass

0.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 157.01798 129.9
[M+Na]+ 178.99992 139.3
[M-H]- 155.00342 129.7
[M+NH4]+ 174.04452 152.8
[M+K]+ 194.97386 137.7
[M+H-H2O]+ 139.00796 125.0
[M+HCOO]- 201.00890 154.2
[M+CH3COO]- 215.02455 175.4
[M+Na-2H]- 176.98537 134.9
[M]+ 156.01015 135.8
[M]- 156.01125 135.8
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe