Common Name: di(8-daidzeinyl)methane
Synonyms: 4H-1-Benzopyran-4-one, 8,8'-methylenebis[7-hydroxy-3-(4-hydroxyphenyl)-
CAS Registry Number: 1601552-77-5
InChI:
InChIKey:
Formula: C31H20O8
Molecular Weight: 520.49
Exact Mass: 520.1158
NMR Solvent: DMSO-d6
MHz: 400.0
Calibration: TMS
NMR references: Xiao, Y., Zhu, X., Yuan, J., Yang, L., Xue, Y., Mao, P., Qu, L. (2014). Synthesis and Characterization of Novel Unnatural Di(8-daidzeinyl)methane. Chem. Nat. Compd. 50, 76-79.
Species: synthesis - Xiao, Y., Zhu, X., Yuan, J., Yang, L., Xue, Y., Mao, P., Qu, L. (2014). Synthesis and Characterization of Novel Unnatural Di(8-daidzeinyl)methane. Chem. Nat. Compd. 50, 76-79.
Notes: Peak types and coupling constants were not reported in 1H NMR data.
Position | PPM | Peak Type | J (Hz) |
---|---|---|---|
2 | 8.31 | ||
5 | 7.83 | ||
6 | 6.88 | ||
2', 6' | 7.37 | ||
3', 5' | 6.78 | ||
CH2 | 4.28 | ||
7-OH | 10.55 | ||
4'-OH | 9.51 |
Position | PPM |
---|---|
2 | 153.1 |
3 | 123.1 |
4 | 175.6 |
5 | 124.8 |
6 | 114.6 |
7 | 160.7 |
8 | 113.8 |
9 | 156.2 |
10 | 117 |
1' | 123.4 |
2', 6' | 130.5 |
3', 5' | 115.4 |
4' | 157.5 |
CH2 | 17.4 |