CID 13231422

Schembl923145

Structural Information

Molecular Formula
C5H11O3P
SMILES
CCOP(=O)(C)CC=O
InChI
InChI=1S/C5H11O3P/c1-3-8-9(2,7)5-4-6/h4H,3,5H2,1-2H3
InChIKey
OUQPKAWTWOTEPK-UHFFFAOYSA-N
Compound name
2-[ethoxy(methyl)phosphoryl]acetaldehyde
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

10
Patents

150.04459 Da
Monoisotopic Mass

-0.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 151.05187 131.4
[M+Na]+ 173.03381 139.7
[M-H]- 149.03731 131.0
[M+NH4]+ 168.07841 153.5
[M+K]+ 189.00775 140.1
[M+H-H2O]+ 133.04185 125.3
[M+HCOO]- 195.04279 160.3
[M+CH3COO]- 209.05844 175.5
[M+Na-2H]- 171.01926 136.3
[M]+ 150.04404 136.7
[M]- 150.04514 136.7
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

patents stripe