Spektraris NMR
2'-Methoxymollugin
Common Name: 2'-Methoxymollugin
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C18H18O5/c1-18(2)13(21-3)9-12-14(17(20)22-4)15(19)10-7-5-6-8-11(10)16(12)23-18/h5-9,19H,1-4H3
InChIKey: InChIKey=OCQKAHAAVZGZPO-UHFFFAOYSA-N
Formula: C18H18O5
Molecular Weight: 314.333204
Exact Mass: 314.115424
NMR Solvent: CDCl3
MHz:
Calibration:
NMR references: 13C - Itokawa, H., Ibraheim, Z.Z., Qiao, Y.F., Takeya, K. Chem Pharm Bull (1993) 41, 1869-72
Species:
Notes: Family : Aromatics, Type : Naphthalenes, Group : Naphthoquinones; 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) | 159.43 |
| 2 (C) | 99.34 |
| 3 (C) | 120.42 |
| 4 (C) | 144.26 |
| 5 (CH) | 125.14 |
| 6 (CH) | 130.19 |
| 7 (CH) | 125.18 |
| 8 (CH) | 120.1 |
| 9 (C) | 125.07 |
| 10 (C) | 123.06 |
| 1' (CH) | 106.63 |
| 2' (C) | 159.85 |
| 3' (C) | 73.77 |
| 4' (CH3) | 25.73 |
| 5' (CH3) | 25.73 |
| 2a (C) | 172.17 |
| 2b (CH3) | 52.24 |
| 2'a (CH3) | 51.35 |
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The Spektraris NMR database is developed and hosted by the Lange laboratory at WSU. CAS Registry Number is a Registered Trademark of the American Chemical Society.