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ent-19-Chlorogibberell-2,6,16-triene
SpectraBase Compound ID JkruBiHt1KG
InChI InChI=1S/C20H27Cl/c1-13-10-20-11-15(13)6-7-16(20)19(4)9-5-8-18(3,12-21)17(19)14(20)2/h5,8,15-17H,1-2,6-7,9-12H2,3-4H3/t15-,16+,17-,18+,19+,20-/m1/s1
InChIKey JBXKSCHIRQJNML-XHYRXIGBSA-N
Mol Weight 302.89 g/mol
Molecular Formula C20H27Cl
Exact Mass 302.180129 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LDHTSkqgh0J
Name ent-19-Chlorogibberell-2,6,16-triene
Alternate Name(s) (1alpha,4aalpha,4bbeta)-1-(chloromethyl)-1,4a-dimethyl-8,10-dimethylenegibb-2-ene
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Formula C20H27Cl
InChI InChI=1S/C20H27Cl/c1-13-10-20-11-15(13)6-7-16(20)19(4)9-5-8-18(3,12-21)17(19)14(20)2/h5,8,15-17H,1-2,6-7,9-12H2,3-4H3/t15-,16+,17-,18+,19+,20-/m1/s1
InChIKey JBXKSCHIRQJNML-XHYRXIGBSA-N
Molecular Weight 302.889 g/mol
SMILES [C@@]123C([C@@]4([C@@](C=CC[C@]4([C@@]3(CC[C@](C1)(C(C2)=C)[H])[H])C)(CCl)C)[H])=C
SPLASH splash10-0zi3-9231000000-a4dc9b84ea490f96db03
Source of Spectrum KC-1992-1362-21
Wiley ID 776314