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ScientificNameLabel
trans-Muurola-1(14),5-diene
PHCD compound ID : 5353
Chemical Names :
trans-Muurola-1(14),5-diene
Molecular Formula : C15H24
Molecular Weight : 204.187801
More Details :
Names & Synonyms:
Smiles: C[C@@H]1CC[C@@H]2C(=C1)[C@H](CCC2=C)C(C)C
InChi : InChI=1S/C15H24/c1-10(2)13-8-6-12(4)14-7-5-11(3)9-15(13)14/h9-11,13-14H,4-8H2,1-3H3/t11-,13-,14+/m1/s1
InChi Key : InChIKey=OANNWHISIGDHJS-BNOWGMLFSA-N
PubChem ID :
Rotatable bond count : 1 Rule of five : 1
Hydrogen bond acceptor count : 0 Ionization potential : 9.184909
Hydrogen bond donor count : 0 Electric dipole moment : 0.906
XLogP : 5.943 VDW volume : 238.010393
Molecular weight : 204.187801 HOMO-LUMO gap : 10.409000
Herb list :
Refrences & Litretures:
  
874.      Journal:'CHEMIJA'      Year:'2007'      Volume:'18'      Page:'44'      DOI:''      Title:'Influence of urban environment on chemical composition of essential oil of Tilia cordata'
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