Spektraris NMR
1,4-Peroxy-muurol-5-ene
Common Name: 1,4-Peroxy-muurol-5-ene
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C15H24O2/c1-10(2)12-6-5-11(3)15-8-7-14(4,16-17-15)9-13(12)15/h9-12H,5-8H2,1-4H3/t11-,12-,14-,15+/m1/s1
InChIKey: InChIKey=GTTLFWBBABXFSP-GBOPCIDUSA-N
Formula: C15H24O2
Molecular Weight: 236.350426
Exact Mass: 236.17763
NMR Solvent: CDCl3
MHz:
Calibration:
NMR references: 13C - Ngo, K.S., Wong, W.T., Brown, G.D. J Nat Prod (1999) 62, 549-53
Species:
Notes: Family : Terpenoids, Type : Sesquiterpenoids, Group : Muurolanes; 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) | 79.3 |
| 2 (CH2) | 21.8 |
| 3 (CH2) | 30 |
| 4 (C) | 75.2 |
| 5 (CH) | 126.3 |
| 6 (C) | 148.4 |
| 7 (CH) | 39.4 |
| 8 (CH2) | 19.3 |
| 9 (CH2) | 26.7 |
| 10 (CH) | 30.6 |
| 11 (CH) | 27.5 |
| 12 (CH3) | 21.4 |
| 13 (CH3) | 16.9 |
| 14 (CH3) | 22 |
| 15 (CH3) | 15.4 |
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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.