Common Name: (+)-(3R)-3-hydroxy-4,4-dimethyl-4-butyrolactone
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C6H10O3/c1-6(2)4(7)3-5(8)9-6/h4,7H,3H2,1-2H3/t4-/m1/s1
InChIKey: InChIKey=SIEVQTNTRMBCHO-SCSAIBSYSA-N
Formula: C6H10O3
Molecular Weight: 130.142038
Exact Mass: 130.062994
NMR Solvent: CDCl3
MHz:
Calibration:
NMR references: 13C - Ahmed, A.A., Hussein, T.A., Mahmoud, A.A., Farag, M.A., Pare, P.W., Wojcinska, M., Karchesy, J., Mabry, T.J. Phytochemistry (2004) 65, 2539-43
Species:
Notes: Family : Miscellanea, Type : Butanolides; 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) | 174.2 |
2 (CH2) | 38.2 |
3 (CH) | 73.8 |
4 (C) | 87.6 |
5 (CH3) | 21 |
6 (CH3) | 26.1 |