CID 18510

Decyl methacrylate

Structural Information

Molecular Formula
C14H26O2
SMILES
CCCCCCCCCCOC(=O)C(=C)C
InChI
InChI=1S/C14H26O2/c1-4-5-6-7-8-9-10-11-12-16-14(15)13(2)3/h2,4-12H2,1,3H3
InChIKey
GTBGXKPAKVYEKJ-UHFFFAOYSA-N
Compound name
decyl 2-methylprop-2-enoate
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

16
References

32295
Patents

226.19328 Da
Monoisotopic Mass

6.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 227.200556 159.6
[M+Na]+ 249.182498 163.8
[M-H]- 225.186004 158.7
[M+NH4]+ 244.227103 177.9
[M+K]+ 265.156438 162.1
[M+H-H2O]+ 209.190540 153.9
[M+HCOO]- 271.191481 179.7
[M+CH3COO]- 285.207131 194.5
[M+Na-2H]- 247.167946 160.0
[M]+ 226.19273142 164.1
[M]- 226.19382858 164.1
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