Spektraris NMR
Bacciferin A
Common Name: Bacciferin A
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C15H26O2/c1-14(2)7-4-8-15(3,17)12-6-5-11(10-16)9-13(12)14/h9,12-13,16-17H,4-8,10H2,1-3H3/t12-,13-,15+/m0/s1
InChIKey: InChIKey=QRYPQTUSGXZGNH-KCQAQPDRSA-N
Formula: C15H26O2
Molecular Weight: 238.366308
Exact Mass: 238.19328
NMR Solvent: CDCl3
MHz:
Calibration:
NMR references: 13C - Lin, L.G., Tang, C.P., Ke, C.Q., Zhang, Y., Ye, Y. J Nat Prod (2008) 71, 628-32
Species:
Notes: Family : Terpenoids, Type : Sesquiterpenoids, Group : Himachalanes; 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) | 51.9 |
| 2 (C) | 76 |
| 3 (CH2) | 36.3 |
| 4 (CH2) | 19.7 |
| 5 (CH2) | 41.3 |
| 6 (C) | 38.2 |
| 7 (CH) | 43 |
| 8 (CH) | 127.4 |
| 9 (C) | 137 |
| 10 (CH2) | 27.2 |
| 11 (CH2) | 21.7 |
| 12 (CH3) | 32.6 |
| 13 (CH3) | 33.3 |
| 14 (CH3) | 26.7 |
| 15 (CH2) | 67.7 |
