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Ethyl 2,4-octadien-6-ynoate

View entire compound with spectra: 1 MS (GC)

Ethyl 2,4-octadien-6-ynoate
SpectraBase Compound ID HNWMSBPxzh2
InChI InChI=1S/C10H12O2/c1-3-5-6-7-8-9-10(11)12-4-2/h6-9H,4H2,1-2H3/b7-6+,9-8+
InChIKey IYUXQAFHORFWSI-BLHCBFLLSA-N
Mol Weight 164.2 g/mol
Molecular Formula C10H12O2
Exact Mass 164.08373 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HvAYqAG6dcB
Name Ethyl 2,4-octadien-6-ynoate
Comments Less than 3 mono-isotopic peaks
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Formula C10H12O2
InChI InChI=1S/C10H12O2/c1-3-5-6-7-8-9-10(11)12-4-2/h6-9H,4H2,1-2H3/b7-6+,9-8+
InChIKey IYUXQAFHORFWSI-BLHCBFLLSA-N
Molecular Weight 164.204 g/mol
SMILES C(\C=C\C=C\C#CC)(=O)OCC
SPLASH splash10-01p9-0900000000-e3448d3c744a4c1b3cce
Source of Spectrum U-1996-1494-8
Synonyms ethyl (2E,4E)-2,4-octadien-6-ynoate
Wiley ID 768926