CID 11856523

3-hydroxy-1-adamantyl methacrylate

Structural Information

Molecular Formula
C14H20O3
SMILES
CC(=C)C(=O)OC12CC3CC(C1)CC(C3)(C2)O
InChI
InChI=1S/C14H20O3/c1-9(2)12(15)17-14-6-10-3-11(7-14)5-13(16,4-10)8-14/h10-11,16H,1,3-8H2,2H3
InChIKey
OOIBFPKQHULHSQ-UHFFFAOYSA-N
Compound name
(3-hydroxy-1-adamantyl) 2-methylprop-2-enoate
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

13384
Patents

236.14125 Da
Monoisotopic Mass

2.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 237.14853 159.3
[M+Na]+ 259.13047 161.5
[M-H]- 235.13397 153.2
[M+NH4]+ 254.17507 184.8
[M+K]+ 275.10441 158.3
[M+H-H2O]+ 219.13851 153.8
[M+HCOO]- 281.13945 163.1
[M+CH3COO]- 295.15510 167.0
[M+Na-2H]- 257.11592 168.1
[M]+ 236.14070 159.6
[M]- 236.14180 159.6
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