CID 44259046
8-c-p-hydroxybenzylkaempferol
Structural Information
- Molecular Formula
- C22H16O7
- SMILES
- C1=CC(=CC=C1CC2=C3C(=C(C=C2O)O)C(=O)C(=C(O3)C4=CC=C(C=C4)O)O)O
- InChI
- InChI=1S/C22H16O7/c23-13-5-1-11(2-6-13)9-15-16(25)10-17(26)18-19(27)20(28)21(29-22(15)18)12-3-7-14(24)8-4-12/h1-8,10,23-26,28H,9H2
- InChIKey
- BFFYUNVGUBDLOC-UHFFFAOYSA-N
- Compound name
- 3,5,7-trihydroxy-2-(4-hydroxyphenyl)-8-[(4-hydroxyphenyl)methyl]chromen-4-one
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 393.09688 | 190.7 |
[M+Na]+ | 415.07882 | 200.4 |
[M-H]- | 391.08232 | 197.4 |
[M+NH4]+ | 410.12342 | 198.5 |
[M+K]+ | 431.05276 | 196.2 |
[M+H-H2O]+ | 375.08686 | 181.6 |
[M+HCOO]- | 437.08780 | 205.8 |
[M+CH3COO]- | 451.10345 | 200.1 |
[M+Na-2H]- | 413.06427 | 193.0 |
[M]+ | 392.08905 | 192.9 |
[M]- | 392.09015 | 192.9 |