Spektraris NMR
OUOQVJYYZABQJT-UHFFFAOYSA-N
Common Name: OUOQVJYYZABQJT-UHFFFAOYSA-N
Synonyms: OUOQVJYYZABQJT-UHFFFAOYSA-N
CAS Registry Number:
InChI: InChI=1S/C15H22/c1-12(2)6-5-7-14(4)15-10-8-13(3)9-11-15/h8-12H,4-7H2,1-3H3
InChIKey: InChIKey=OUOQVJYYZABQJT-UHFFFAOYSA-N
Formula: C15H22
Molecular Weight: 202.335735
Exact Mass: 202.172151
NMR Solvent: CDCl3
MHz:
Calibration:
NMR references: 13C - Adio, A.M., Konig, W.A. Phytochemistry (2005) 66, 599-609
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 (CH) | 126.7 |
| 2 (CH) | 129.6 |
| 3 (C) | 137.1 |
| 4 (CH) | 129.6 |
| 5 (CH) | 126.7 |
| 6 (C) | 139.2 |
| 7 (C) | 149.1 |
| 8 (CH2) | 36.3 |
| 9 (CH2) | 26.7 |
| 10 (CH2) | 39.2 |
| 11 (CH) | 28.4 |
| 12 (CH3) | 23 |
| 13 (CH3) | 23 |
| 14 (CH2) | 111.8 |
| 15 (CH3) | 21.3 |
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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.