CID 144130
11-hexadecyn-1-ol
Structural Information
- Molecular Formula
- C16H30O
- SMILES
- CCCCC#CCCCCCCCCCCO
- InChI
- InChI=1S/C16H30O/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17/h17H,2-4,7-16H2,1H3
- InChIKey
- CWJKFTYJCIEEDB-UHFFFAOYSA-N
- Compound name
- hexadec-11-yn-1-ol
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 239.23694 | 157.7 |
[M+Na]+ | 261.21888 | 163.6 |
[M-H]- | 237.22238 | 155.0 |
[M+NH4]+ | 256.26348 | 173.4 |
[M+K]+ | 277.19282 | 159.4 |
[M+H-H2O]+ | 221.22692 | 146.3 |
[M+HCOO]- | 283.22786 | 172.2 |
[M+CH3COO]- | 297.24351 | 200.6 |
[M+Na-2H]- | 259.20433 | 159.3 |
[M]+ | 238.22911 | 156.2 |
[M]- | 238.23021 | 156.2 |