CID 11698

597-25-1

Structural Information

Molecular Formula
C6H14NO4P
SMILES
COP(=O)(N1CCOCC1)OC
InChI
InChI=1S/C6H14NO4P/c1-9-12(8,10-2)7-3-5-11-6-4-7/h3-6H2,1-2H3
InChIKey
BZXUQIDKDGGYPB-UHFFFAOYSA-N
Compound name
4-dimethoxyphosphorylmorpholine
Related CIDs

2D Structure

compound 2d structure
6
Annotation Hits

1
References

7
Patents

195.06604 Da
Monoisotopic Mass

-0.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 196.07332 141.8
[M+Na]+ 218.05526 147.3
[M-H]- 194.05876 142.8
[M+NH4]+ 213.09986 158.8
[M+K]+ 234.02920 149.5
[M+H-H2O]+ 178.06330 133.3
[M+HCOO]- 240.06424 165.4
[M+CH3COO]- 254.07989 180.7
[M+Na-2H]- 216.04071 146.7
[M]+ 195.06549 143.4
[M]- 195.06659 143.4
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