CID 6446397
4-hydroxy stiripentol
Structural Information
- Molecular Formula
- C14H20O3
- SMILES
- CC(C)(C)C(/C=C/C1=CC(=C(C=C1)O)OC)O
- InChI
- InChI=1S/C14H20O3/c1-14(2,3)13(16)8-6-10-5-7-11(15)12(9-10)17-4/h5-9,13,15-16H,1-4H3/b8-6+
- InChIKey
- KZMOPPALPUQHAR-SOFGYWHQSA-N
- Compound name
- 4-[(E)-3-hydroxy-4,4-dimethylpent-1-enyl]-2-methoxyphenol
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 237.14853 | 155.5 |
[M+Na]+ | 259.13047 | 162.3 |
[M-H]- | 235.13397 | 156.6 |
[M+NH4]+ | 254.17507 | 172.5 |
[M+K]+ | 275.10441 | 159.4 |
[M+H-H2O]+ | 219.13851 | 150.4 |
[M+HCOO]- | 281.13945 | 173.7 |
[M+CH3COO]- | 295.15510 | 188.7 |
[M+Na-2H]- | 257.11592 | 158.3 |
[M]+ | 236.14070 | 156.6 |
[M]- | 236.14180 | 156.6 |
Literature stripe
No literature data available for this compound.
Patent stripe
No patent data available for this compound.