CID 3023825

2-methyltridecyl methacrylate

Structural Information

Molecular Formula
C18H34O2
SMILES
CCCCCCCCCCCC(C)COC(=O)C(=C)C
InChI
InChI=1S/C18H34O2/c1-5-6-7-8-9-10-11-12-13-14-17(4)15-20-18(19)16(2)3/h17H,2,5-15H2,1,3-4H3
InChIKey
ZYNRPKSDNPNGAS-UHFFFAOYSA-N
Compound name
2-methyltridecyl 2-methylprop-2-enoate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

28
Patents

282.2559 Da
Monoisotopic Mass

7.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 283.263176 178.3
[M+Na]+ 305.245118 180.6
[M-H]- 281.248624 176.7
[M+NH4]+ 300.289723 194.3
[M+K]+ 321.219058 178.3
[M+H-H2O]+ 265.253160 171.9
[M+HCOO]- 327.254101 196.1
[M+CH3COO]- 341.269751 207.2
[M+Na-2H]- 303.230566 175.2
[M]+ 282.25535142 183.7
[M]- 282.25644858 183.7
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