Spektraris NMR
Angelicoidenol
Common Name: Angelicoidenol
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C10H18O2/c1-9(2)6-4-8(12)10(9,3)5-7(6)11/h6-8,11-12H,4-5H2,1-3H3/t6-,7-,8+,10+/m0/s1
InChIKey: InChIKey=HLVIHBJQDKVEAL-QHOPCYEYSA-N
Formula: C10H18O2
Molecular Weight: 170.249102
Exact Mass: 170.13068
NMR Solvent: C5D5N
MHz:
Calibration:
NMR references: 13C - Mahmood, U., Singh, S.B., Thakur, R.S. Phytochemistry (1983) 22, 774-6
Species:
Notes: Family : Terpenoids, Type : Monoterpenoids, Group : Camphanes; 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 (CH) | 53.7 |
| 2 (CH2) | 37.1 |
| 3 (CH) | 75 |
| 4 (C) | 50.8 |
| 5 (CH2) | 39.6 |
| 6 (CH) | 75 |
| 7 (C) | 47.9 |
| 8 (CH3) | 20.2 |
| 9 (CH3) | 21.8 |
| 10 (CH3) | 13.5 |
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