Spektraris NMR
Parahigginol D
Common Name: Parahigginol D
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C15H18O3/c1-10(2)5-4-6-11(3)13-8-7-12(9-16)14(17)15(13)18/h4-9,11,17-18H,1-3H3/b6-4+
InChIKey: InChIKey=HYIQPOJSOSXRKS-GQCTYLIASA-N
Formula: C15H18O3
Molecular Weight: 246.302187
Exact Mass: 246.125594
NMR Solvent: CDCl3
MHz:
Calibration:
NMR references: 13C - Chen, C.Y., Shen, Y.C., Chen, Y.J., Sheu, J.H., Duh, C.Y. J Nat Prod (1999) 62, 573-6
Species:
Notes: Family : Terpenoids, Type : Sesquiterpenoids, Group : Bisabolanes; 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) | 141.7 |
| 2 (C) | 148.1 |
| 3 (C) | 118.7 |
| 4 (CH) | 123.9 |
| 5 (CH) | 118.7 |
| 6 (C) | 140.4 |
| 7 (CH) | 35.9 |
| 8 (CH) | 133.7 |
| 9 (CH) | 126.2 |
| 10 (CH) | 124.8 |
| 11 (C) | 134.3 |
| 12 (CH3) | 18.3 |
| 13 (CH3) | 25.9 |
| 14 (CH3) | 19.7 |
| 15 (CH) | 196.2 |
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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.