CID 81080

1,6-hexanediol dimethacrylate

Structural Information

Molecular Formula
C14H22O4
SMILES
CC(=C)C(=O)OCCCCCCOC(=O)C(=C)C
InChI
InChI=1S/C14H22O4/c1-11(2)13(15)17-9-7-5-6-8-10-18-14(16)12(3)4/h1,3,5-10H2,2,4H3
InChIKey
SAPGBCWOQLHKKZ-UHFFFAOYSA-N
Compound name
6-(2-methylprop-2-enoyloxy)hexyl 2-methylprop-2-enoate
Related CIDs

2D Structure

compound 2d structure
5
Annotation Hits

26
References

35202
Patents

254.15181 Da
Monoisotopic Mass

3.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 255.15909 161.8
[M+Na]+ 277.14103 166.2
[M-H]- 253.14453 161.1
[M+NH4]+ 272.18563 178.7
[M+K]+ 293.11497 165.3
[M+H-H2O]+ 237.14907 156.2
[M+HCOO]- 299.15001 180.9
[M+CH3COO]- 313.16566 197.6
[M+Na-2H]- 275.12648 160.0
[M]+ 254.15126 166.5
[M]- 254.15236 166.5
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