CID 206759
28673-57-6
Structural Information
- Molecular Formula
- C16H26O2
- SMILES
- CC(C)(C1=CCC(CC1)C2CCCCC2)C(=O)O
- InChI
- InChI=1S/C16H26O2/c1-16(2,15(17)18)14-10-8-13(9-11-14)12-6-4-3-5-7-12/h10,12-13H,3-9,11H2,1-2H3,(H,17,18)
- InChIKey
- OJNQXRQCOHSFHG-UHFFFAOYSA-N
- Compound name
- 2-(4-cyclohexylcyclohexen-1-yl)-2-methylpropanoic acid
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 251.20056 | 161.5 |
[M+Na]+ | 273.18250 | 162.9 |
[M-H]- | 249.18600 | 164.9 |
[M+NH4]+ | 268.22710 | 177.3 |
[M+K]+ | 289.15644 | 160.2 |
[M+H-H2O]+ | 233.19054 | 155.0 |
[M+HCOO]- | 295.19148 | 174.5 |
[M+CH3COO]- | 309.20713 | 192.9 |
[M+Na-2H]- | 271.16795 | 162.0 |
[M]+ | 250.19273 | 153.7 |
[M]- | 250.19383 | 153.7 |
Literature stripe
No literature data available for this compound.
Patent stripe
No patent data available for this compound.