CID 74190

Ethyl dihydrogen phosphate

Structural Information

Molecular Formula
C2H7O4P
SMILES
CCOP(=O)(O)O
InChI
InChI=1S/C2H7O4P/c1-2-6-7(3,4)5/h2H2,1H3,(H2,3,4,5)
InChIKey
ZJXZSIYSNXKHEA-UHFFFAOYSA-N
Compound name
ethyl dihydrogen phosphate
Related CIDs

2D Structure

compound 2d structure
7
Annotation Hits

31
References

24965
Patents

126.008194 Da
Monoisotopic Mass

-1.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 127.01547 124.0
[M+Na]+ 148.99741 132.2
[M-H]- 125.00092 121.0
[M+NH4]+ 144.04202 145.5
[M+K]+ 164.97135 132.5
[M+H-H2O]+ 109.00545 118.4
[M+HCOO]- 171.00640 150.7
[M+CH3COO]- 185.02204 164.1
[M+Na-2H]- 146.98286 129.3
[M]+ 126.00765 126.2
[M]- 126.00874 126.2
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