CID 138159
Cyclohexylidenecyclohexane
Structural Information
- Molecular Formula
- C12H20
- SMILES
- C1CCC(=C2CCCCC2)CC1
- InChI
- InChI=1S/C12H20/c1-3-7-11(8-4-1)12-9-5-2-6-10-12/h1-10H2
- InChIKey
- FJHVMZDLYBHASM-UHFFFAOYSA-N
- Compound name
- cyclohexylidenecyclohexane
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 165.16378 | 140.0 |
[M+Na]+ | 187.14572 | 141.5 |
[M-H]- | 163.14922 | 144.5 |
[M+NH4]+ | 182.19032 | 159.7 |
[M+K]+ | 203.11966 | 138.9 |
[M+H-H2O]+ | 147.15376 | 133.2 |
[M+HCOO]- | 209.15470 | 156.5 |
[M+CH3COO]- | 223.17035 | 176.8 |
[M+Na-2H]- | 185.13117 | 142.9 |
[M]+ | 164.15595 | 128.8 |
[M]- | 164.15705 | 128.8 |