| SpectraBase Compound ID | 6FREJrirAqs |
|---|---|
| InChI | InChI=1S/C29H24O12/c30-11-3-17(32)15-8-21(36)28(40-23(15)5-11)10-1-13-14(7-20(35)27(39)25(13)26(38)19(34)2-10)29-22(37)9-16-18(33)4-12(31)6-24(16)41-29/h1-7,21-22,28-33,35-37,39H,8-9H2,(H,34,38)/t21-,22-,28-,29-/m0/s1 |
| InChIKey | IPMYMEWFZKHGAX-VXBCSTRESA-N |
| Mol Weight | 564.5 g/mol |
| Molecular Formula | C29H24O12 |
| Exact Mass | 564.126776 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
View the Full Spectrum for FREE!
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | 8g48lcitck8 |
|---|---|
| Name | THEAFLAVIN |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C29H24O12 |
| InChI | InChI=1S/C29H24O12/c30-11-3-17(32)15-8-21(36)28(40-23(15)5-11)10-1-13-14(7-20(35)27(39)25(13)26(38)19(34)2-10)29-22(37)9-16-18(33)4-12(31)6-24(16)41-29/h1-7,21-22,28-33,35-37,39H,8-9H2,(H,34,38)/t21-,22-,28-,29-/m0/s1 |
| InChIKey | IPMYMEWFZKHGAX-VXBCSTRESA-N |
| Literature Reference Author | A.L.DAVIS,Y.CAI,A.P.DAVIES |
| Literature Reference Citation | MAGN.RES.CHEM.,33,549(1995) |
| Literature Reference DOI | 10.1002/mrc.1260330709 |
| Molecular Weight | 564.502 g/mol |
| Solvent | ACETONE-D6 |
| Source File Reference | UWMZ4860 |