Spektraris NMR
Me cryptostrobin
Common Name: Me cryptostrobin
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C16H14O4/c1-9-11(17)7-12(18)15-13(19)8-14(20-16(9)15)10-5-3-2-4-6-10/h2-7,14,17-18H,8H2,1H3
InChIKey: InChIKey=QSRIZZQWNHKERT-UHFFFAOYSA-N
Formula: C16H14O4
Molecular Weight: 270.280565
Exact Mass: 270.089209
NMR Solvent: DMSO-d6
MHz:
Calibration:
NMR references: 13C - L.J. Byrne, J.R. Cannon, D.H. Gawad, B.S. Joshi, B.W. Skelton, R.F. Toia, A.H. White Aust J Chem (1982) 35, 1851-8
Species:
Notes: Family : Flavonoids, Type : Flavonoids, Group : Flavanones; 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 |
|---|---|
| 2 (CH) | 77.9 |
| 3 (CH2) | 41.9 |
| 4 (C) | 196.1 |
| 5 (C) | 160.9 |
| 6 (CH) | 95.2 |
| 7 (C) | 164.6 |
| 8 (C) | 102.6 |
| 9 (C) | 159.5 |
| 10 (C) | 101.7 |
| 1' (C) | 139 |
| 2' (CH) | 126.2 |
| 3' (CH) | 128.5 |
| 4' (CH) | 128.2 |
| 5' (CH) | 128.5 |
| 6' (CH) | 126.2 |
| 8a (CH3) | 7.5 |
