CID 86765

2-butenediol 1,4-diacrylate

Structural Information

Molecular Formula
C10H12O4
SMILES
C=CC(=O)OCC=CCOC(=O)C=C
InChI
InChI=1S/C10H12O4/c1-3-9(11)13-7-5-6-8-14-10(12)4-2/h3-6H,1-2,7-8H2
InChIKey
ZJWKFUBDXPALAF-UHFFFAOYSA-N
Compound name
4-prop-2-enoyloxybut-2-enyl prop-2-enoate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

67
Patents

196.07356 Da
Monoisotopic Mass

1.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 197.08084 141.7
[M+Na]+ 219.06278 148.5
[M-H]- 195.06628 141.7
[M+NH4]+ 214.10738 161.0
[M+K]+ 235.03672 147.1
[M+H-H2O]+ 179.07082 136.7
[M+HCOO]- 241.07176 164.3
[M+CH3COO]- 255.08741 182.3
[M+Na-2H]- 217.04823 144.5
[M]+ 196.07301 145.4
[M]- 196.07411 145.4
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