Spektraris NMR
Isofarnesyl Formamide
Common Name: Isofarnesyl Formamide
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C16H27NO/c1-14(2)7-5-8-15(3)9-6-10-16(4)11-12-17-13-18/h7,9,11,13H,5-6,8,10,12H2,1-4H3,(H,17,18)/b15-9+,16-11-
InChIKey: InChIKey=PDBXISFZFHLDEE-VGJYFWKZSA-N
Formula: C16H27N1O1
Molecular Weight: 249.392323
Exact Mass: 249.209264
NMR Solvent: C+C+C
MHz:
Calibration:
NMR references: 13C - Li, Z.Y., Yu, Z.G., Guo, Y.W. Helv Chim Acta (2008) 91, 1553-8
Species:
Notes: Family : Terpenoids, Type : Sesquiterpenoids, Group : Farnesanes; 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) | 35.8 |
| 2 (CH) | 120.1 |
| 3 (C) | 140.8 |
| 4 (CH2) | 31.9 |
| 5 (CH2) | 26.2 |
| 6 (CH) | 123.5 |
| 7 (C) | 135.9 |
| 8 (CH2) | 39.7 |
| 9 (CH2) | 26.7 |
| 10 (CH) | 124.2 |
| 11 (C) | 131.5 |
| 12 (CH3) | 25.7 |
| 13 (CH3) | 17.7 |
| 14 (CH3) | 16 |
| 15 (CH3) | 23.3 |
| 1a (CH) | 160.8 |
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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.