CID 103698

52892-97-4

Structural Information

Molecular Formula
C16H24O4
SMILES
CC(=C)C(=O)OCC1CCC(CC1)COC(=O)C(=C)C
InChI
InChI=1S/C16H24O4/c1-11(2)15(17)19-9-13-5-7-14(8-6-13)10-20-16(18)12(3)4/h13-14H,1,3,5-10H2,2,4H3
InChIKey
NKIDFMYWMSBSRA-UHFFFAOYSA-N
Compound name
[4-(2-methylprop-2-enoyloxymethyl)cyclohexyl]methyl 2-methylprop-2-enoate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

1379
Patents

280.16745 Da
Monoisotopic Mass

3.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 281.17473 167.5
[M+Na]+ 303.15667 174.6
[M+NH4]+ 298.20127 172.5
[M+K]+ 319.13061 170.8
[M-H]- 279.16017 166.2
[M+Na-2H]- 301.14212 167.9
[M]+ 280.16690 167.6
[M]- 280.16800 167.6
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