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ScientificNameLabel
4-Tridecene
PHCD compound ID : 227
Chemical Names :
4-Tridecene
Molecular Formula : C13H26
Molecular Weight : 182.203451
More Details :
Names & Synonyms: (E)-tridec-4-ene , (E)-4-tridecene
Smiles: CCCCCCCC/C=C/CCC
InChi : InChI=1S/C13H26/c1-3-5-7-9-11-13-12-10-8-6-4-2/h7,9H,3-6,8,10-13H2,1-2H3/b9-7+
InChi Key : InChIKey=UJZLNVCZGZKIHR-VQHVLOKHSA-N
PubChem ID : 5463211
Rotatable bond count : 9 Rule of five : 1
Hydrogen bond acceptor count : 0 Ionization potential : 9.527930
Hydrogen bond donor count : 0 Electric dipole moment : 0.127
XLogP : 7.221 VDW volume : 230.7678
Molecular weight : 182.203451 HOMO-LUMO gap : 10.819000
Herb list :
Refrences & Litretures:
  
14.      Journal:'Phytochem. Anal. 2014, 25, 273'      Year:'2014'      Volume:'25'      Page:'273'      DOI:'10.1002/pca.2503'      Title:'Chemometric Resolution Approaches in Characterisation of Volatile Constituents in Plantago ovata Seeds using Gas Chromatography–Mass Spectrometry: Methodology and Performance Assessment'
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