CID 16722
Undecanenitrile
Structural Information
- Molecular Formula
- C11H21N
- SMILES
- CCCCCCCCCCC#N
- InChI
- InChI=1S/C11H21N/c1-2-3-4-5-6-7-8-9-10-11-12/h2-10H2,1H3
- InChIKey
- SZKKNEOUHLFYNA-UHFFFAOYSA-N
- Compound name
- undecanenitrile
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 168.17468 | 137.0 |
[M+Na]+ | 190.15662 | 144.3 |
[M-H]- | 166.16012 | 137.2 |
[M+NH4]+ | 185.20122 | 155.9 |
[M+K]+ | 206.13056 | 142.6 |
[M+H-H2O]+ | 150.16466 | 125.5 |
[M+HCOO]- | 212.16560 | 156.1 |
[M+CH3COO]- | 226.18125 | 195.8 |
[M+Na-2H]- | 188.14207 | 142.0 |
[M]+ | 167.16685 | 135.2 |
[M]- | 167.16795 | 135.2 |