Spektraris NMR
Hirsutenol B
Common Name: Hirsutenol B
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C15H22O3/c1-8-10(16)5-9-6-15(18)7-13(2,3)12(17)11(15)14(8,9)4/h5,8,11-12,17-18H,6-7H2,1-4H3/t8-,11-,12+,14+,15+/m0/s1
InChIKey: InChIKey=SWEMDFMQXLKKFA-CARMDJQYSA-N
Formula: C15H22O3
Molecular Weight: 250.33395
Exact Mass: 250.156895
NMR Solvent: CD3OD
MHz:
Calibration:
NMR references: 13C - Yun, B.S., Lee, I.K., Cho, Y., Cho, S.M., Yoo, I.D. J Nat Prod (2002) 65, 786-8
Species:
Notes: Family : Terpenoids, Type : Sesquiterpenoids, Group : Hirsutanes; 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) | 81.2 |
| 2 (CH) | 67.4 |
| 3 (C) | 53.6 |
| 4 (CH) | 59.1 |
| 5 (C) | 214.7 |
| 6 (CH) | 123.3 |
| 7 (C) | 194.2 |
| 8 (CH2) | 44.9 |
| 9 (C) | 87 |
| 10 (CH2) | 53.3 |
| 11 (C) | 45.2 |
| 12 (CH3) | 21.1 |
| 13 (CH3) | 27.9 |
| 14 (CH3) | 21 |
| 15 (CH3) | 9.4 |
