Spektraris NMR
Cherianoine
Common Name: Cherianoine
Synonyms: Cherianoine
CAS Registry Number:
InChI: InChI=1S/C12H13NO4/c1-13-5-4-7-6-8(16-2)10(14)11(17-3)9(7)12(13)15/h4-6,14H,1-3H3
InChIKey: InChIKey=OJLLODMRNXRZIT-UHFFFAOYSA-N
Formula: C12H13N1O4
Molecular Weight: 235.236423
Exact Mass: 235.084458
NMR Solvent: CDCl3
MHz:
Calibration:
NMR references: 13C - Chen C.Y., Chang F.R., Pan W.B., Wu Y.C. Phytochemistry (2001) 56, 753-7
Species:
Notes: Family : Alkaloids, Type : Isoquinolines; 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) | 161.3 |
| 3 (CH) | 131.1 |
| 4 (CH) | 105.4 |
| 5 (CH) | 106.1 |
| 6 (C) | 150.6 |
| 7 (C) | 143.5 |
| 8 (C) | 143.1 |
| 9 (C) | 132.8 |
| 10 (C) | 131.4 |
| 2a (CH3) | 37.8 |
| 6a (CH3) | 52.5 |
| 8a (CH3) | 56.4 |
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The Spektraris NMR database is developed and hosted by the Lange laboratory at WSU. CAS Registry Number is a Registered Trademark of the American Chemical Society.