CID 162635

2-propenoic acid, 2-methyl-, (1-methyl-1,2-ethanediyl)bis(oxy(methyl-2,1-ethanediyl)) ester

Structural Information

Molecular Formula
C17H28O6
SMILES
CC(COCC(C)OC(=O)C(=C)C)OCC(C)OC(=O)C(=C)C
InChI
InChI=1S/C17H28O6/c1-11(2)16(18)22-14(6)9-20-8-13(5)21-10-15(7)23-17(19)12(3)4/h13-15H,1,3,8-10H2,2,4-7H3
InChIKey
WJWQVBVYZZTOSK-UHFFFAOYSA-N
Compound name
1-[2-[2-(2-methylprop-2-enoyloxy)propoxy]propoxy]propan-2-yl 2-methylprop-2-enoate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

2
Patents

328.1886 Da
Monoisotopic Mass

2.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 329.19588 177.6
[M+Na]+ 351.17782 181.9
[M+NH4]+ 346.22242 198.7
[M+K]+ 367.15176 192.7
[M-H]- 327.18132 172.1
[M+Na-2H]- 349.16327 174.5
[M]+ 328.18805 175.9
[M]- 328.18915 175.9
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