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1-(Ethoxycarbonyl)-2-(butanoyl)ethylene
SpectraBase Compound ID D0MWVIEJMuP
InChI InChI=1S/C9H14O3/c1-3-5-8(10)6-7-9(11)12-4-2/h6-7H,3-5H2,1-2H3/b7-6+
InChIKey ILAQIEBDDCLEJA-VOTSOKGWSA-N
Mol Weight 170.21 g/mol
Molecular Formula C9H14O3
Exact Mass 170.094294 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GGuT3ae8oJA
Name 1-(Ethoxycarbonyl)-2-(butanoyl)ethylene
Alternate Name(s) Ethyl (2E)-4-oxo-2-heptenoate (E)-4-oxo-2-heptenoic acid ethyl ester Ethyl (E)-4-oxohept-2-enoate Ethyl (E)-4-oxidanylidenehept-2-enoate
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Formula C9H14O3
InChI InChI=1S/C9H14O3/c1-3-5-8(10)6-7-9(11)12-4-2/h6-7H,3-5H2,1-2H3/b7-6+
InChIKey ILAQIEBDDCLEJA-VOTSOKGWSA-N
Molecular Weight 170.208 g/mol
SMILES C(\C=C\C(=O)OCC)(CCC)=O
SPLASH splash10-0002-9300000000-8d067c425ada7bb12199
Source of Spectrum K1-2000-2800-20
Wiley ID 749979