Spektraris NMR
Massarinolin B
Common Name: Massarinolin B
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C15H22O4/c1-9(13(17)18)5-11(16)7-15-8-19-14(2)4-3-10(15)6-12(14)15/h5,10-12,16H,3-4,6-8H2,1-2H3,(H,17,18)/b9-5+/t10-,11+,12-,14+,15-/m0/s1
InChIKey: InChIKey=GWNSZLIEAQMRLS-SUAOZZTGSA-N
Formula: C15H22O4
Molecular Weight: 266.333355
Exact Mass: 266.151809
NMR Solvent: CD3OD
MHz:
Calibration:
NMR references: 13C - Oh, H., Gloer, J.B., Shearer, C.A. J Nat Prod (1999) 62, 497-501
Species:
Notes: Family : Terpenoids, Type : Sesquiterpenoids, Group : Miscellanea; 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 (CH2) | 23.5 |
| 2 (CH) | 53.6 |
| 3 (C) | 87.6 |
| 4 (CH2) | 33.4 |
| 5 (CH2) | 23.8 |
| 6 (CH) | 40.3 |
| 7 (C) | 55.5 |
| 8 (CH2) | 41.8 |
| 9 (CH) | 67.1 |
| 10 (CH) | 145.3 |
| 11 (C) | 128.5 |
| 12 (C) | 171.5 |
| 13 (CH3) | 12.7 |
| 14 (CH2) | 72.7 |
| 15 (CH3) | 25.3 |
