Spektraris NMR
(-)-(1S,4R)-3-(3'-Furyl)Methyl-1-Hidroxy-2-p-Menthen-1,7-Diol (Acetate)
Common Name: (-)-(1S,4R)-3-(3'-Furyl)Methyl-1-Hidroxy-2-p-Menthen-1,7-Diol (Acetate)
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C17H24O4/c1-12(2)16-4-6-17(19,11-21-13(3)18)9-15(16)8-14-5-7-20-10-14/h5,7,9-10,12,16,19H,4,6,8,11H2,1-3H3/t16-,17+/m1/s1
InChIKey: InChIKey=QXZJAZHTTRQRET-SJORKVTESA-N
Formula: C17H24O4
Molecular Weight: 292.370708
Exact Mass: 292.167459
NMR Solvent: C6D6
MHz:
Calibration:
NMR references: 13C - Guella, G., Guerriero, A., Pietra, F. Helv Chim Acta (1985) 68, 39-48
Species:
Notes: Family : Terpenoids, Type : Monoterpenoids, Group : p-Menthanes; 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) | 70.2 |
| 2 (CH) | 128.9 |
| 3 (C) | 143.1 |
| 4 (CH) | 41.7 |
| 5 (CH2) | 19.3 |
| 6 (CH2) | 30.9 |
| 7 (CH2) | 69.7 |
| 8 (CH) | 27.9 |
| 9 (CH3) | 16.8 |
| 10 (CH3) | 20.8 |
| 3a (CH2) | 31.9 |
| 3b (C) | 122.9 |
| 3c (CH) | 111.7 |
| 3d (CH) | 143.1 |
| 3e (CH) | 140.1 |
| 7a (C) | 170.8 |
| 7b (CH3) | 20.5 |
