Common Name: Ethyl Gallate
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C9H10O5/c1-2-14-9(13)5-3-6(10)8(12)7(11)4-5/h3-4,10-12H,2H2,1H3
InChIKey: InChIKey=VFPFQHQNJCMNBZ-UHFFFAOYSA-N
Formula: C9H10O5
Molecular Weight: 198.173055
Exact Mass: 198.052823
NMR Solvent: C5D5N
MHz:
Calibration:
NMR references: 13C - Du, Z.Z., He, H.P., Wu, B., Shen, Y.M., Hao, X.J. Helv Chim Acta (2004) 87, 758-63
Species:
Notes: Family : Aromatics, Type : Benzenes; 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)
Position | PPM |
---|---|
1 (C) | 121.8 |
2 (CH) | 110.6 |
3 (C) | 148 |
4 (C) | 141.4 |
5 (C) | 148 |
6 (CH) | 110.6 |
7 (C) | 167.7 |
7a (CH2) | 61.1 |
7b (CH3) | 15 |