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Ethyl (E)-2-methyl-7-oxooct-2-enoate
SpectraBase Compound ID 9CGT5ZRVubi
InChI InChI=1S/C11H18O3/c1-4-14-11(13)9(2)7-5-6-8-10(3)12/h7H,4-6,8H2,1-3H3/b9-7+
InChIKey UQTSFQRZGGXLHL-VQHVLOKHSA-N
Mol Weight 198.26 g/mol
Molecular Formula C11H18O3
Exact Mass 198.125594 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DVkdz6xwl8N
Name Ethyl (E)-2-methyl-7-oxooct-2-enoate
Alternate Name(s) (E)-ethyl 2-methyl-7-oxooct-2-enoate (E)-2-methyl-7-oxo-2-octenoic acid ethyl ester Ethyl (E)-2-methyl-7-oxo-oct-2-enoate Ethyl (E)-2-methyl-7-oxidanylidene-oct-2-enoate
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Formula C11H18O3
InChI InChI=1S/C11H18O3/c1-4-14-11(13)9(2)7-5-6-8-10(3)12/h7H,4-6,8H2,1-3H3/b9-7+
InChIKey UQTSFQRZGGXLHL-VQHVLOKHSA-N
Molecular Weight 198.262 g/mol
SMILES C(\C(=C\CCCC(=O)C)C)(=O)OCC
SPLASH splash10-0uea-9700000000-20da8c0a33ee1795b320
Source of Spectrum F5-4-3160-7e
Wiley ID 1732937