Common Name: 2-C-methyl-D-erythritol
Synonyms: 2-C-methyl-D-erythritol
CAS Registry Number:
InChI: InChI=1S/C5H12O4/c1-5(9,3-7)4(8)2-6/h4,6-9H,2-3H2,1H3/t4-,5+/m1/s1
InChIKey: InChIKey=HGVJFBSSLICXEM-UHNVWZDZSA-N
Formula: C5H12O4
Molecular Weight: 136.146588
Exact Mass: 136.073559
NMR Solvent: C5D5N
MHz:
Calibration:
NMR references: 13C - Kitajima J., Ishikawa T., Fujimatu E., Kondho K., Takayanagi T. Phytochemistry (2003) 62, 115-20
Species:
Notes: Family : Carbohydrates, Type : Monosaccharides; 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 (CH2) | 68.88 |
2 (C) | 74.71 |
3 (CH) | 76.07 |
4 (CH2) | 63.97 |
5 (CH3) | 20.71 |