Spektraris NMR
Cyperenoic acid
Common Name: Cyperenoic acid
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C15H22O2/c1-9-4-5-10-8-12-11(13(16)17)6-7-15(9,12)14(10,2)3/h9-10H,4-8H2,1-3H3,(H,16,17)/t9-,10-,15+/m1/s1
InChIKey: InChIKey=MFODEBYPUFXURM-FCHSOHFDSA-N
Formula: C15H22O2
Molecular Weight: 234.334545
Exact Mass: 234.16198
NMR Solvent: CDCl3
MHz:
Calibration:
NMR references: 13C - Xu, Y., Zhang, H.W., Wan, X.C., Zou, Z.M. Magn Reson Chem (2009) 47, 527-31
Species:
Notes: Family : Terpenoids, Type : Sesquiterpenoids, Group : Patchoulanes; 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) | 68.2 |
| 2 (CH2) | 25.7 |
| 3 (CH2) | 36.3 |
| 4 (C) | 123.1 |
| 5 (C) | 173.1 |
| 6 (CH2) | 31.3 |
| 7 (CH) | 48.2 |
| 8 (CH2) | 26.9 |
| 9 (CH2) | 27.9 |
| 10 (CH) | 35.9 |
| 11 (C) | 41.7 |
| 12 (CH3) | 19.3 |
| 13 (CH3) | 26.2 |
| 14 (CH3) | 17.9 |
| 15 (C) | 170.6 |
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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.