CID 11544716
Chebi:169928
Structural Information
- Molecular Formula
- C20H24O5
- SMILES
- C/C=C/C=C/C=C/C(=O)[C@@H](C)C[C@@H](C)C(=O)C1=C(C(=C)OC1=O)OC
- InChI
- InChI=1S/C20H24O5/c1-6-7-8-9-10-11-16(21)13(2)12-14(3)18(22)17-19(24-5)15(4)25-20(17)23/h6-11,13-14H,4,12H2,1-3,5H3/b7-6+,9-8+,11-10+/t13-,14+/m0/s1
- InChIKey
- DWDVLBRQUCLSIZ-JKCIQWBTSA-N
- Compound name
- (2R,4S,6E,8E,10E)-1-(4-methoxy-5-methylidene-2-oxofuran-3-yl)-2,4-dimethyldodeca-6,8,10-triene-1,5-dione
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 345.16966 | 182.1 |
[M+Na]+ | 367.15160 | 187.6 |
[M-H]- | 343.15510 | 185.6 |
[M+NH4]+ | 362.19620 | 196.1 |
[M+K]+ | 383.12554 | 184.6 |
[M+H-H2O]+ | 327.15964 | 176.6 |
[M+HCOO]- | 389.16058 | 199.9 |
[M+CH3COO]- | 403.17623 | 214.4 |
[M+Na-2H]- | 365.13705 | 176.3 |
[M]+ | 344.16183 | 186.7 |
[M]- | 344.16293 | 186.7 |
Literature stripe
Patent stripe
No patent data available for this compound.