CID 20140
Valnoctamide
Structural Information
- Molecular Formula
- C8H17NO
- SMILES
- CCC(C)C(CC)C(=O)N
- InChI
- InChI=1S/C8H17NO/c1-4-6(3)7(5-2)8(9)10/h6-7H,4-5H2,1-3H3,(H2,9,10)
- InChIKey
- QRCJOCOSPZMDJY-UHFFFAOYSA-N
- Compound name
- 2-ethyl-3-methylpentanamide
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 144.13829 | 134.6 |
[M+Na]+ | 166.12023 | 142.7 |
[M+NH4]+ | 161.16483 | 141.8 |
[M+K]+ | 182.09417 | 138.8 |
[M-H]- | 142.12373 | 133.8 |
[M+Na-2H]- | 164.10568 | 136.7 |
[M]+ | 143.13046 | 135.1 |
[M]- | 143.13156 | 135.1 |