CID 21391884
124618-81-1
Structural Information
- Molecular Formula
- C6H11N
- SMILES
- CCC#CCCN
- InChI
- InChI=1S/C6H11N/c1-2-3-4-5-6-7/h2,5-7H2,1H3
- InChIKey
- BOSJIPJDUDDZAA-UHFFFAOYSA-N
- Compound name
- hex-3-yn-1-amine
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 98.096426 | 121.3 |
[M+Na]+ | 120.07837 | 131.4 |
[M+NH4]+ | 115.12297 | 126.3 |
[M+K]+ | 136.05231 | 122.5 |
[M-H]- | 96.081874 | 114.1 |
[M+Na-2H]- | 118.06382 | 123.1 |
[M]+ | 97.088601 | 119.7 |
[M]- | 97.089699 | 119.7 |