Spektraris NMR
Hirsutenol A
Common Name: Hirsutenol A
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C15H20O3/c1-7-10(16)6-8-5-9-11(15(7,8)4)13(18)14(2,3)12(9)17/h7-8,13,18H,5-6H2,1-4H3/t7-,8-,13+,15+/m0/s1
InChIKey: InChIKey=JDNHHSVZZOCUOM-WCBQKTFOSA-N
Formula: C15H20O3
Molecular Weight: 248.318068
Exact Mass: 248.141245
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) | 75.5 |
| 2 (C) | 189 |
| 3 (C) | 54.7 |
| 4 (CH) | 51.6 |
| 5 (C) | 221.9 |
| 6 (CH2) | 42.2 |
| 7 (CH) | 51.1 |
| 8 (CH2) | 32.2 |
| 9 (C) | 145.6 |
| 10 (C) | 209.7 |
| 11 (C) | 55.5 |
| 12 (CH3) | 24 |
| 13 (CH3) | 20.9 |
| 14 (CH3) | 18.7 |
| 15 (CH3) | 9.6 |
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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.