CID 88615
2-(azepan-1-yl)ethanol
Structural Information
- Molecular Formula
- C8H17NO
- SMILES
- C1CCCN(CC1)CCO
- InChI
- InChI=1S/C8H17NO/c10-8-7-9-5-3-1-2-4-6-9/h10H,1-8H2
- InChIKey
- VMRYMOMQCYSPHS-UHFFFAOYSA-N
- Compound name
- 2-(azepan-1-yl)ethanol
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 144.13829 | 129.2 |
[M+Na]+ | 166.12023 | 137.3 |
[M+NH4]+ | 161.16483 | 136.7 |
[M+K]+ | 182.09417 | 133.3 |
[M-H]- | 142.12373 | 129.9 |
[M+Na-2H]- | 164.10568 | 134.0 |
[M]+ | 143.13046 | 130.3 |
[M]- | 143.13156 | 130.3 |