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(1S,2S,3R,5R,6S,9S,10R,11S)-(-)-Pentacyclo[7.4.0.0(2,6).0(3,11).0(5,10)] -trideca-7,12-diene
SpectraBase Compound ID 2KExQD1i75h
InChI InChI=1S/C13H14/c1-3-8-10-5-11-9-4-2-7(13(8)11)6(1)12(9)10/h1-4,6-13H,5H2/t6-,7-,8-,9+,10-,11+,12+,13+/m1/s1
InChIKey SUVKEGDRHFCULU-YKXRINGMSA-N
Mol Weight 170.25 g/mol
Molecular Formula C13H14
Exact Mass 170.10955 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EMElmvNoPFo
Name (1S,2S,3R,5R,6S,9S,10R,11S)-(-)-Pentacyclo[7.4.0.0(2,6).0(3,11).0(5,10)] -trideca-7,12-diene
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Formula C13H14
InChI InChI=1S/C13H14/c1-3-8-10-5-11-9-4-2-7(13(8)11)6(1)12(9)10/h1-4,6-13H,5H2/t6-,7-,8-,9+,10-,11+,12+,13+/m1/s1
InChIKey SUVKEGDRHFCULU-YKXRINGMSA-N
Molecular Weight 170.255 g/mol
SMILES [C@@]12([C@]3([C@]4([H])[C@]5([C@@]([C@]2(C[C@]5([C@@]1(C=C4)[H])[H])[H])(C=C3)[H])[H])[H])[H]
SPLASH splash10-0006-9000000000-a0e8d8d0b300cbe9dc79
Source of Spectrum K-126-2290-0
Synonyms (1R,2S,3S,5R,6R,9S,10R,11S)-pentacyclo[7.4.0.0(2,6).0(3,11).0(5,10)]trideca-7,12-diene
Wiley ID 1167681