CID 140885
1-adamantyl isocyanide
Structural Information
- Molecular Formula
- C11H15N
- SMILES
- [C-]#[N+]C12CC3CC(C1)CC(C3)C2
- InChI
- InChI=1S/C11H15N/c1-12-11-5-8-2-9(6-11)4-10(3-8)7-11/h8-10H,2-7H2
- InChIKey
- RPRJRJNIFAYHRF-UHFFFAOYSA-N
- Compound name
- 1-isocyanoadamantane
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 162.12773 | 140.9 |
[M+Na]+ | 184.10967 | 147.9 |
[M-H]- | 160.11317 | 137.3 |
[M+NH4]+ | 179.15427 | 165.3 |
[M+K]+ | 200.08361 | 133.4 |
[M+H-H2O]+ | 144.11771 | 134.8 |
[M+HCOO]- | 206.11865 | 146.9 |
[M+CH3COO]- | 220.13430 | 189.8 |
[M+Na-2H]- | 182.09512 | 152.5 |
[M]+ | 161.11990 | 132.9 |
[M]- | 161.12100 | 132.9 |