CID 170237

2,2-bis(4-hydroxycyclohexyl)propane dimethacrylate

Structural Information

Molecular Formula
C23H36O4
SMILES
CC(=C)C(=O)OC1CCC(CC1)C(C)(C)C2CCC(CC2)OC(=O)C(=C)C
InChI
InChI=1S/C23H36O4/c1-15(2)21(24)26-19-11-7-17(8-12-19)23(5,6)18-9-13-20(14-10-18)27-22(25)16(3)4/h17-20H,1,3,7-14H2,2,4-6H3
InChIKey
RIVWLNPMWPTCEP-UHFFFAOYSA-N
Compound name
[4-[2-[4-(2-methylprop-2-enoyloxy)cyclohexyl]propan-2-yl]cyclohexyl] 2-methylprop-2-enoate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

60
Patents

376.26135 Da
Monoisotopic Mass

6.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 377.26863 191.7
[M+Na]+ 399.25057 190.6
[M-H]- 375.25407 195.4
[M+NH4]+ 394.29517 202.8
[M+K]+ 415.22451 188.6
[M+H-H2O]+ 359.25861 184.8
[M+HCOO]- 421.25955 200.5
[M+CH3COO]- 435.27520 221.1
[M+Na-2H]- 397.23602 184.8
[M]+ 376.26080 186.3
[M]- 376.26190 186.3
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