Spektraris NMR
11,13-Dihidrovernodalin
Common Name: 11,13-Dihidrovernodalin
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C19H22O7/c1-5-19-6-12(25-16(21)9(2)7-20)13-10(3)18(23)26-15(13)14(19)11(4)17(22)24-8-19/h5,10,12-15,20H,1-2,4,6-8H2,3H3/t10-,12-,13+,14+,15-,19+/m0/s1
InChIKey: InChIKey=YWLGRTPMZJKCHR-KGMASNGISA-N
Formula: C19H22O7
Molecular Weight: 362.374513
Exact Mass: 362.136553
NMR Solvent: CDCl3
MHz:
Calibration:
NMR references: 13C - Ganjian, I., Kubo, I., Fludzinski, P. Phytochemistry (1983) 22, 2525-6
Species:
Notes: Family : Terpenoids, Type : Sesquiterpenoids, Group : Elemanes; 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 (CH2) | 70 |
| 3 (C) | 164.5 |
| 4 (C) | 129.8 |
| 5 (CH) | 40.5 |
| 6 (CH) | 77.7 |
| 7 (CH) | 53.8 |
| 8 (CH) | 68.9 |
| 9 (CH2) | 38 |
| 10 (C) | 40 |
| 11 (CH) | 45.7 |
| 12 (C) | 176.8 |
| 13 (CH3) | 13.8 |
| 14 (CH) | 116.1 |
| 15 (CH2) | 134.8 |
| 8a (C) | 162.9 |
| 8b (C) | 138.4 |
| 8c (CH2) | 60.8 |
| 8d (CH2) | 125.8 |
| 14a (CH2) | 139.2 |
