Common Name: XGWAKSLJEAVSMI-NDMJEZRESA-
Synonyms: XGWAKSLJEAVSMI-NDMJEZRESA-
CAS Registry Number:
InChI: InChI=1S/C13H20O2/c1-8(2)11-5-4-9(3)12-6-10(14)7-13(11,12)15/h6,8-9,11,15H,4-5,7H2,1-3H3/t9-,11+,13-/m0/s1
InChIKey: InChIKey=XGWAKSLJEAVSMI-NDMJEZRESA-N
Formula: C13H20O2
Molecular Weight: 208.297192
Exact Mass: 208.14633
NMR Solvent: CD3COCD3
MHz:
Calibration:
NMR references: 13C - Song, F., Xu, X., Li, S., Wang, S., Zhao, J., Cao, P., Yang, Y., Fan, X., Shi, J., He, L., Lu, Y. J Nat Prod (2005) 68, 1309-13
Species:
Notes: Family : Terpenoids, Type : Sesquiterpenoids, Group : Miscellanea; 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)
Position | PPM |
---|---|
1 (C) | 185.7 |
2 (CH) | 129.1 |
3 (C) | 206.1 |
4 (CH2) | 48.4 |
5 (C) | 80.6 |
6 (CH) | 49.6 |
7 (CH2) | 20.4 |
8 (CH2) | 29.5 |
9 (CH) | 33.8 |
10 (CH3) | 22.2 |
11 (CH) | 29.6 |
12 (CH3) | 18.4 |
13 (CH3) | 23.6 |