Spektraris NMR
Axiplyns C
Common Name: Axiplyns C
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C16H25NOS/c1-11(2)12-5-8-16(4,17-10-19)14-6-7-15(3,18)9-13(12)14/h9,11-12,14,18H,5-8H2,1-4H3/t12-,14+,15-,16-/m0/s1
InChIKey: InChIKey=RDQPBBPUCUTPAG-UKMLZYKCSA-N
Formula: C16H25N1O1S1
Molecular Weight: 279.442526
Exact Mass: 279.165685
NMR Solvent: CD3OD
MHz:
Calibration:
NMR references: 13C - Sorek, H., Zelikoff, A.L., Benayahu, Y., Kashman, Y. Tetrahedron Lett (2008) 49, 2200-3
Species:
Notes: Family : Terpenoids, Type : Sesquiterpenoids, Group : Miscellanea; 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) | 47.6 |
| 2 (CH2) | 20 |
| 3 (CH2) | 31.5 |
| 4 (C) | 77.7 |
| 5 (CH) | 126.5 |
| 6 (C) | 142.9 |
| 7 (CH) | 47.6 |
| 8 (CH2) | 22.3 |
| 9 (CH2) | 39.9 |
| 10 (C) | 66.5 |
| 11 (CH) | 27 |
| 12 (CH3) | 17.7 |
| 13 (CH3) | 22.1 |
| 14 (CH3) | 25.6 |
| 15 (CH3) | 25.8 |
| 10a (C) | 130 |
