CID 10888854
Tridec-12-en-2-one
Structural Information
- Molecular Formula
- C13H24O
- SMILES
- CC(=O)CCCCCCCCCC=C
- InChI
- InChI=1S/C13H24O/c1-3-4-5-6-7-8-9-10-11-12-13(2)14/h3H,1,4-12H2,2H3
- InChIKey
- UYCZPLKICNDOCL-UHFFFAOYSA-N
- Compound name
- tridec-12-en-2-one
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 197.18999 | 151.2 |
[M+Na]+ | 219.17193 | 156.0 |
[M-H]- | 195.17543 | 150.4 |
[M+NH4]+ | 214.21653 | 170.8 |
[M+K]+ | 235.14587 | 153.7 |
[M+H-H2O]+ | 179.17997 | 145.8 |
[M+HCOO]- | 241.18091 | 172.4 |
[M+CH3COO]- | 255.19656 | 189.5 |
[M+Na-2H]- | 217.15738 | 153.4 |
[M]+ | 196.18216 | 154.6 |
[M]- | 196.18326 | 154.6 |