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(E)-7-hydroxy-2-isopropoxy-hept-2-enoic acid ethyl ester
SpectraBase Compound ID DJOQtpwtw0P
InChI InChI=1S/C12H22O4/c1-4-15-12(14)11(16-10(2)3)8-6-5-7-9-13/h8,10,13H,4-7,9H2,1-3H3/b11-8+
InChIKey ABZGSYYTRWYZSN-DHZHZOJOSA-N
Mol Weight 230.3 g/mol
Molecular Formula C12H22O4
Exact Mass 230.151809 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DKY9DDzsjn3
Name (E)-7-hydroxy-2-isopropoxy-hept-2-enoic acid ethyl ester
Alternate Name(s) (E)-7-hydroxy-2-propan-2-yloxy-2-heptenoic acid ethyl ester Ethyl (E)-7-hydroxy-2-isopropoxy-hept-2-enoate Ethyl (E)-7-hydroxy-2-propan-2-yloxyhept-2-enoate Ethyl (E)-7-oxidanyl-2-propan-2-yloxy-hept-2-enoate
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Formula C12H22O4
InChI InChI=1S/C12H22O4/c1-4-15-12(14)11(16-10(2)3)8-6-5-7-9-13/h8,10,13H,4-7,9H2,1-3H3/b11-8+
InChIKey ABZGSYYTRWYZSN-DHZHZOJOSA-N
Molecular Weight 230.304 g/mol
SMILES OCCCC\C=C/(C(=O)OCC)OC(C)C
SPLASH splash10-00di-9700000000-f488f830be8c64dfcd1e
Source of Spectrum F-48-3997-4
Wiley ID 1231686