Spektraris NMR
602-63-1
Common Name: 602-63-1
Synonyms: 602-63-1
CAS Registry Number:
InChI: InChI=1S/C15H10O4/c1-7-6-10-11(15(19)12(7)16)14(18)9-5-3-2-4-8(9)13(10)17/h2-6,16,19H,1H3
InChIKey: InChIKey=QPAGCTACMMYJIO-UHFFFAOYSA-N
Formula: C15H10O4
Molecular Weight: 254.238066
Exact Mass: 254.057909
NMR Solvent: DMSO-d6
MHz:
Calibration:
NMR references: 13C - Wu, Y.B., Zheng, C.J., Qin, L.P., Sun, L.N., Han, T., Jiao, L., Zhang, Q.Y., Wu, J.Z. Molecules (2009) 14, 573-83
Species:
Notes: Family : Aromatics, Type : Anthraquinones, Group : Anthraquinones; 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 |
|---|---|
| 1 (C) | 162.8 |
| 2 (C) | 162.42 |
| 3 (C) | 133 |
| 4 (CH) | 107.32 |
| 4a (C) | 131.74 |
| 5 (CH) | 126.36 |
| 6 (CH) | 134.54 |
| 7 (CH) | 134.44 |
| 8 (CH) | 126.69 |
| 8a (C) | 132.89 |
| 9 (C) | 186.26 |
| 9a (C) | 117.32 |
| 10 (C) | 181.82 |
| 10a (C) | 108.98 |
| 3a (CH3) | 8.04 |
