CID 10541

Trimethyl phosphate

Structural Information

Molecular Formula
C3H9O4P
SMILES
COP(=O)(OC)OC
InChI
InChI=1S/C3H9O4P/c1-5-8(4,6-2)7-3/h1-3H3
InChIKey
WVLBCYQITXONBZ-UHFFFAOYSA-N
Compound name
trimethyl phosphate
Related CIDs

2D Structure

compound 2d structure
6
Annotation Hits

85
References

81166
Patents

140.02385 Da
Monoisotopic Mass

-0.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 141.031126 126.0
[M+Na]+ 163.013068 134.7
[M-H]- 139.016574 125.8
[M+NH4]+ 158.057673 148.5
[M+K]+ 178.987008 136.7
[M+H-H2O]+ 123.021110 119.9
[M+HCOO]- 185.022051 155.6
[M+CH3COO]- 199.037701 172.5
[M+Na-2H]- 160.998516 132.0
[M]+ 140.02330142 132.6
[M]- 140.02439858 132.6
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