Biological Magnetic Resonance Data Bank

A Repository for Data from NMR Spectroscopy on Proteins, Peptides, Nucleic Acids, and other Biomolecules
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Trans-Nerolidol synonyms


Graphical representations:


View large 3D structure

Molecular Formula: C15H26O

Natural Isotopic Abundance Mass: 222.36634

Mono-Isotopic Molecular Masses:

  • C12N14: 222.198365452
  • C13N14: 237.248688022
  • C12N15: 222.198365452
  • C13N15: 237.248688022

InChI string: InChI=1S/C15H26O/c1-6-15(5,16)12-8-11-14(4)10-7-9-13(2)3/h6,9,11,16H,1,7-8,10,12H2,2-5H3/b14-11+/t15-/m1/s1

IUPAC: (3S,6E)-3,7,11-trimethyldodeca-1,6,10-trien-3-ol

PubChem Compound (CID): 5281525

Reference data were obtained primarily from the PubChem database.

Three dimensional molecular rendering uses Jmol.

InChI string and atom numbering calculated using ALATIS (Hesam Dashti, William M. Westler, John L. Markley, Hamid R. Eghbalnia, "Unique identifiers for small molecules enable rigorous labeling of their atoms", Scientific Data 4, Article number: 170073 (2017), doi:10.1038/sdata.2017.73,