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(E)-1-ethyl 7-methyl 3-bromo-6-methylene-2-heptenoate
SpectraBase Compound ID G1OsQQGtWVl
InChI InChI=1S/C11H15BrO4/c1-4-16-10(13)7-9(12)6-5-8(2)11(14)15-3/h7H,2,4-6H2,1,3H3/b9-7+
InChIKey ZRMLKAWWKVIVJX-VQHVLOKHSA-N
Mol Weight 291.14 g/mol
Molecular Formula C11H15BrO4
Exact Mass 290.015372 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7TGIladAaZx
Name (E)-1-ethyl 7-methyl 3-bromo-6-methylene-2-heptenoate
Alternate Name(s) (E)-1-ethyl 7-methyl 3-bromo-6-methylenehept-2-enedioate (E)-3-bromo-6-methylene-2-heptenedioic acid O1-ethyl ester O7-methyl ester 1-O-ethyl 7-O-methyl (E)-3-bromo-6-methylidenehept-2-enedioate O1-ethyl O7-methyl (E)-3-bromo-6-methylene-hept-2-enedioate O1-ethyl O7-methyl (E)-3-bromanyl-6-methylidene-hept-2-enedioate
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Formula C11H15BrO4
InChI InChI=1S/C11H15BrO4/c1-4-16-10(13)7-9(12)6-5-8(2)11(14)15-3/h7H,2,4-6H2,1,3H3/b9-7+
InChIKey ZRMLKAWWKVIVJX-VQHVLOKHSA-N
Literature Reference DOI 10.1021/ol201395p
Molecular Weight 291.141 g/mol
SMILES C(\C=C/(Br)CCC(=C)C(OC)=O)(OCC)=O
SPLASH splash10-03fr-2790000000-b96c56273af1d72ee14c
Source of Spectrum A1-13-3864/SMS13-E_3e
Wiley ID 1753518