Spektraris NMR
Nigrolineabiphenyl A
Common Name: Nigrolineabiphenyl A
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C14H14O5/c1-18-12-6-9(7-13(19-2)14(12)17)8-3-4-10(15)11(16)5-8/h3-7,15-17H,1-2H3
InChIKey: InChIKey=ZZOCAYOGNJRKQA-UHFFFAOYSA-N
Formula: C14H14O5
Molecular Weight: 262.258498
Exact Mass: 262.084124
NMR Solvent: CDCl3
MHz:
Calibration:
NMR references: 13C - Rukachaisirikul, V., Tadpetch, K., Watthanaphanit, A., Saengsanae, N., Phongpaichit, S. J Nat Prod (2005) 68, 1218-21
Species:
Notes: Family : Aromatics, Type : Biphenyls; 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 (C) | 132.6 |
| 2 (CH) | 103.7 |
| 3 (C) | 147.2 |
| 4 (C) | 134 |
| 5 (C) | 147.2 |
| 6 (CH) | 103.7 |
| 1' (C) | 134.8 |
| 2' (CH) | 113.9 |
| 3' (C) | 144 |
| 4' (C) | 143 |
| 5' (CH) | 115.4 |
| 6' (CH) | 119.2 |
| 3a (CH3) | 56.3 |
| 5a (CH3) | 56.3 |
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