Spektraris NMR
4-[(1S)-1-Phenylallyl]-1,2-benzenediol
![4-[(1S)-1-Phenylallyl]-1,2-benzenediol](/nmr/static/nmr/svg/8439.svg)
Common Name: 4-[(1S)-1-Phenylallyl]-1,2-benzenediol
Synonyms: 4-[(1S)-1-Phenylallyl]-1,2-benzenediol
CAS Registry Number:
InChI: InChI=1S/C15H14O2/c1-2-13(11-6-4-3-5-7-11)12-8-9-14(16)15(17)10-12/h2-10,13,16-17H,1H2/t13-/m0/s1
InChIKey: InChIKey=OTJLSKLGXRCVFQ-ZDUSSCGKSA-N
Formula: C15H14O2
Molecular Weight: 226.271019
Exact Mass: 226.09938
NMR Solvent: CDCl3
MHz:
Calibration:
NMR references: 13C - Awale, S., Shrestha, S.P., Tezuka, Y., Ueda, J.Y., Matsushige, K., Kadota, S. J Nat Prod (2005) 68, 858-64
Species:
Notes: Family : Flavonoids, Type : Neoflavonoids, Group : ; 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 (CH2) | 117.1 |
| 3 (CH) | 139.1 |
| 4 (CH) | 49.1 |
| 5 (CH) | 116.4 |
| 6 (C) | 149.5 |
| 7 (C) | 147.4 |
| 8 (CH) | 114.4 |
| 9 (CH) | 117.3 |
| 10 (C) | 130.4 |
| 1' (C) | 141.2 |
| 2' (CH) | 128.6 |
| 3' (CH) | 128.6 |
| 4' (CH) | 126.8 |
| 5' (CH) | 128.6 |
| 6' (CH) | 128.6 |
