Spektraris NMR
2a-Hydroxyanisatin
Common Name: 2a-Hydroxyanisatin
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C15H20O9/c1-5-7(16)8(17)15(22)13(5)3-6(24-10(19)9(13)18)12(2,21)14(15)4-23-11(14)20/h5-9,16-18,21-22H,3-4H2,1-2H3/t5-,6-,7-,8-,9+,12+,13+,14+,15-/m1/s1
InChIKey: InChIKey=UVYUXRVHTAFBAR-WREXFIEUSA-N
Formula: C15H20O9
Molecular Weight: 344.314498
Exact Mass: 344.110732
NMR Solvent: CD3OD
MHz:
Calibration:
NMR references: 13C - Huang, J.M., Nakade, K., Kondo, M., Yang, C.S., Fukuyama, Y. Chem Pharm Bull (2002) 50, 133-6
Species:
Notes: Family : Terpenoids, Type : Sesquiterpenoids, Group : Prezizaanes; 13 C Spectrum from Naproc 13: José Luis López-Pérez, Roberto Therón, Esther del Olmo, David Díaz: NAPROC-13: a database for the dereplication of natural product mixtures in bioassay-guided protocols. Bioinformatics 23(23):3256-3257 (2007)
Carbon NMR Peaks
| Position | PPM |
|---|---|
| 1 (CH) | 48.3 |
| 2 (CH) | 77.2 |
| 3 (CH) | 70.7 |
| 4 (C) | 85 |
| 5 (C) | 48.3 |
| 6 (C) | 75.4 |
| 7 (CH) | 82.5 |
| 8 (CH2) | 27.6 |
| 9 (C) | 48.3 |
| 10 (CH) | 69.9 |
| 11 (C) | 175.7 |
| 12 (CH3) | 21.9 |
| 13 (C) | 169.3 |
| 14 (CH2) | 65.6 |
| 15 (CH3) | 11.7 |
