CID 90551

24599-21-1

Structural Information

Molecular Formula

C₆H₁₁O₆P

SMILES

CC(=C)C(=O)OCCOP(=O)(O)O

InChI

InChI=1S/C6H11O6P/c1-5(2)6(7)11-3-4-12-13(8,9)10/h1,3-4H2,2H3,(H2,8,9,10)

InChIKey

SEILKFZTLVMHRR-UHFFFAOYSA-N

Compound name

2-phosphonooxyethyl 2-methylprop-2-enoate

Related CIDs

2D Structure

compound 2d structure

2
Annotation Hits: 40
References: 21472
Patents: 210.02933 Da
Monoisotopic Mass: -0.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Å²) per adduct calculated using CCSbase.
Adduct	m/z	Predicted CCS (Å²)
[M+H]+	211.03661	143.5
[M+Na]+	233.01855	149.9
[M-H]-	209.02205	140.0
[M+NH4]+	228.06315	161.2
[M+K]+	248.99249	150.2
[M+H-H2O]+	193.02659	137.0
[M+HCOO]-	255.02753	167.9
[M+CH3COO]-	269.04318	179.7
[M+Na-2H]-	231.00400	144.9
[M]+	210.02878	147.3
[M]-	210.02988	147.3

Literature stripe

literature stripe

Patent stripe

patents stripe