CID 44259656
8-desmethylkalmiatin
Structural Information
- Molecular Formula
- C19H18O6
- SMILES
- CC1=C(C=C2C(=C1O)C(=O)C(=C(O2)C3=CC=C(C=C3)OC)OC)OC
- InChI
- InChI=1S/C19H18O6/c1-10-13(23-3)9-14-15(16(10)20)17(21)19(24-4)18(25-14)11-5-7-12(22-2)8-6-11/h5-9,20H,1-4H3
- InChIKey
- DFXKVAVMILIIHO-UHFFFAOYSA-N
- Compound name
- 5-hydroxy-3,7-dimethoxy-2-(4-methoxyphenyl)-6-methylchromen-4-one
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 343.11763 | 176.8 |
[M+Na]+ | 365.09957 | 188.1 |
[M-H]- | 341.10307 | 185.5 |
[M+NH4]+ | 360.14417 | 190.1 |
[M+K]+ | 381.07351 | 186.5 |
[M+H-H2O]+ | 325.10761 | 168.5 |
[M+HCOO]- | 387.10855 | 197.9 |
[M+CH3COO]- | 401.12420 | 213.1 |
[M+Na-2H]- | 363.08502 | 180.9 |
[M]+ | 342.10980 | 185.8 |
[M]- | 342.11090 | 185.8 |
Literature stripe
Patent stripe
No patent data available for this compound.