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
2
Annotation Hits

0
References

65
Patents

196.07356 Da
Monoisotopic Mass

1.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 197.080836 141.7
[M+Na]+ 219.062778 148.5
[M-H]- 195.066284 141.7
[M+NH4]+ 214.107383 161.0
[M+K]+ 235.036718 147.1
[M+H-H2O]+ 179.070820 136.7
[M+HCOO]- 241.071761 164.3
[M+CH3COO]- 255.087411 182.3
[M+Na-2H]- 217.048226 144.5
[M]+ 196.07301142 145.4
[M]- 196.07410858 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