CID 155760

Einecs 277-072-7

Structural Information

Molecular Formula
C15H24O8
SMILES
CC(COCC(COC(=O)C=C)O)OCC(COC(=O)C=C)O
InChI
InChI=1S/C15H24O8/c1-4-14(18)22-9-12(16)7-20-6-11(3)21-8-13(17)10-23-15(19)5-2/h4-5,11-13,16-17H,1-2,6-10H2,3H3
InChIKey
GCOLLKHHJFDBMV-UHFFFAOYSA-N
Compound name
[2-hydroxy-3-[2-(2-hydroxy-3-prop-2-enoyloxypropoxy)propoxy]propyl] prop-2-enoate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

64
Patents

332.14713 Da
Monoisotopic Mass

0.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 333.15441 176.6
[M+Na]+ 355.13635 178.8
[M-H]- 331.13985 172.6
[M+NH4]+ 350.18095 189.1
[M+K]+ 371.11029 179.0
[M+H-H2O]+ 315.14439 170.2
[M+HCOO]- 377.14533 188.3
[M+CH3COO]- 391.16098 205.0
[M+Na-2H]- 353.12180 172.4
[M]+ 332.14658 182.9
[M]- 332.14768 182.9
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