CID 21156023

71566-43-3

Structural Information

Molecular Formula
C3H9ClNO3P
SMILES
CN(C)C(P(=O)(O)O)Cl
InChI
InChI=1S/C3H9ClNO3P/c1-5(2)3(4)9(6,7)8/h3H,1-2H3,(H2,6,7,8)
InChIKey
HLXNGXGHLKWUNU-UHFFFAOYSA-N
Compound name
[chloro(dimethylamino)methyl]phosphonic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

173.00085 Da
Monoisotopic Mass

-3.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 174.00813 132.2
[M+Na]+ 195.99007 140.1
[M-H]- 171.99357 130.8
[M+NH4]+ 191.03467 153.1
[M+K]+ 211.96401 139.3
[M+H-H2O]+ 155.99811 127.3
[M+HCOO]- 217.99905 154.7
[M+CH3COO]- 232.01470 178.2
[M+Na-2H]- 193.97552 135.1
[M]+ 173.00030 135.1
[M]- 173.00140 135.1
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.