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(1'R)-Pentyl 2'-propenyl 2-butynoate
SpectraBase Compound ID HLTURSiksPh
InChI InChI=1S/C12H18O2/c1-4-7-8-10-11(6-3)14-12(13)9-5-2/h6,11H,3-4,7-8,10H2,1-2H3/t11-/m1/s1
InChIKey DXKXFEUPAVWMMF-LLVKDONJSA-N
Mol Weight 194.27 g/mol
Molecular Formula C12H18O2
Exact Mass 194.13068 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Jh1N2tGLDZS
Name (1'R)-Pentyl 2'-propenyl 2-butynoate
Alternate Name(s) (1S)-1-pentyl-2-propenyl 2-butynoate 2-Butynoic acid[(3S)-oct-1-en-3-yl]ester But-2-ynoic acid[(1S)-1-amylallyl]ester [(1S)-1-vinylhexyl]but-2-ynoate [(3S)-oct-1-en-3-yl]but-2-ynoate 2-Butynoic acid [(3S)-oct-1-en-3-yl] ester [(1S)-1-vinylhexyl] but-2-ynoate [(3S)-oct-1-en-3-yl] but-2-ynoate
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Formula C12H18O2
InChI InChI=1S/C12H18O2/c1-4-7-8-10-11(6-3)14-12(13)9-5-2/h6,11H,3-4,7-8,10H2,1-2H3/t11-/m1/s1
InChIKey DXKXFEUPAVWMMF-LLVKDONJSA-N
Molecular Weight 194.274 g/mol
SMILES C(C(=O)O[C@](C=C)(CCCCC)[H])#CC
SPLASH splash10-0a4j-9200000000-6a42f10b83058a391c1f
Source of Spectrum QC-6-1663-2
Wiley ID 868994