CID 85931
3,3,5-trimethylcyclohexylamine
Structural Information
- Molecular Formula
- C9H19N
- SMILES
- CC1CC(CC(C1)(C)C)N
- InChI
- InChI=1S/C9H19N/c1-7-4-8(10)6-9(2,3)5-7/h7-8H,4-6,10H2,1-3H3
- InChIKey
- ZGMQLPDXPUINCQ-UHFFFAOYSA-N
- Compound name
- 3,3,5-trimethylcyclohexan-1-amine
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 142.15903 | 132.4 |
[M+Na]+ | 164.14097 | 143.0 |
[M+NH4]+ | 159.18557 | 143.3 |
[M+K]+ | 180.11491 | 134.9 |
[M-H]- | 140.14447 | 135.5 |
[M+Na-2H]- | 162.12642 | 138.9 |
[M]+ | 141.15120 | 134.8 |
[M]- | 141.15230 | 134.8 |