CID 11856523

115372-36-6

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

12986
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 157.5
[M+Na]+ 259.13047 164.8
[M+NH4]+ 254.17507 170.0
[M+K]+ 275.10441 155.2
[M-H]- 235.13397 153.8
[M+Na-2H]- 257.11592 154.2
[M]+ 236.14070 157.5
[M]- 236.14180 157.5
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