Spektraris NMR
Kasarin
Common Name: Kasarin
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C15H23N3O5/c1-6-9(4)13-14(23-11(20)7-10(16)19)17-12(8(2)3)15(21)18(13)22-5/h8-9H,6-7H2,1-5H3,(H2,16,19)
InChIKey: InChIKey=WAWQBZYQXCRDEM-UHFFFAOYSA-N
Formula: C15H23N3O5
Molecular Weight: 325.36093
Exact Mass: 325.163771
NMR Solvent: CDCl3
MHz:
Calibration:
NMR references: 13C - Kita, M., Miwa, R., Widianti, T., Ozaki, Y., Aoyama, S., Yamada, K., Uemura, D. Tetrahedron Lett (2007) 48, 8628-31
Species:
Notes: Family : Alkaloids, Type : Pyrazines; 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 |
|---|---|
| 2 (C) | 152 |
| 3 (C) | 161.5 |
| 5 (C) | 134.9 |
| 6 (C) | 135 |
| 7 (CH) | 33.7 |
| 8 (CH2) | 27.5 |
| 9 (CH3) | 12.6 |
| 10 (CH3) | 18.2 |
| 11 (CH) | 30.7 |
| 12 (CH3) | 19.9 |
| 13 (CH3) | 19.9 |
| 1' (C) | 166 |
| 2' (CH2) | 41.1 |
| 3' (C) | 168 |
| 1a (CH3) | 64.1 |
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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.