Spektraris NMR
d1-Iridomyrmecin
Common Name: d1-Iridomyrmecin
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C10H16O2/c1-6-3-4-8-7(2)10(11)12-5-9(6)8/h6-9H,3-5H2,1-2H3/t6-,7?,8+,9+/m0/s1
InChIKey: InChIKey=LYEFRAMOOLOUKA-KKVHJZIVSA-N
Formula: C10H16O2
Molecular Weight: 168.233221
Exact Mass: 168.11503
NMR Solvent: CDCl3
MHz:
Calibration:
NMR references: 13C - Grieco, P.A., Srinivasan, C.V. J Org Chem (1981) 46, 2591-3
Species:
Notes: Family : Terpenoids, Type : Monoterpenoids, Group : Iridoids; 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 (CH2) | 68 |
| 3 (C) | 176.2 |
| 4 (CH) | 45.6 |
| 5 (CH) | 37.4 |
| 6 (CH2) | 29.8 |
| 7 (CH2) | 34.3 |
| 8 (CH) | 38 |
| 9 (CH) | 41.4 |
| 10 (CH3) | 18.4 |
| 11 (CH3) | 12.7 |
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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.