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Methyl (E)-2-(1-octynyl)-2-heptenoate
SpectraBase Compound ID 8whImqKy0JA
InChI InChI=1S/C16H26O2/c1-4-6-8-9-10-12-14-15(16(17)18-3)13-11-7-5-2/h13H,4-11H2,1-3H3/b15-13+
InChIKey LLJOMVRGOWICBB-FYWRMAATSA-N
Mol Weight 250.38 g/mol
Molecular Formula C16H26O2
Exact Mass 250.19328 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID E04u2and5YX
Name Methyl (E)-2-(1-octynyl)-2-heptenoate
Alternate Name(s) Methyl (2E)-2-pentylidene-3-decynoate
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Formula C16H26O2
InChI InChI=1S/C16H26O2/c1-4-6-8-9-10-12-14-15(16(17)18-3)13-11-7-5-2/h13H,4-11H2,1-3H3/b15-13+
InChIKey LLJOMVRGOWICBB-FYWRMAATSA-N
Molecular Weight 250.382 g/mol
SMILES C(\C(C(=O)OC)=C/CCCC)#CCCCCCC
SPLASH splash10-00mo-9720000000-d35e2b2d5866c7cf7b76
Source of Spectrum PS-54-145-19
Wiley ID 805187