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(E)-3-((2-(4-bromobenzylidene)cyclopropyl)methylene)pentane-2,4-dione
SpectraBase Compound ID H1vQUJI6dK3
InChI InChI=1S/C16H15BrO2/c1-10(18)16(11(2)19)9-14-8-13(14)7-12-3-5-15(17)6-4-12/h3-7,9,14H,8H2,1-2H3/b13-7+
InChIKey YMSKDYFBSKPAGS-NTUHNPAUSA-N
Mol Weight 319.2 g/mol
Molecular Formula C16H15BrO2
Exact Mass 318.025543 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3kS8fZvxmi
Name (E)-3-((2-(4-bromobenzylidene)cyclopropyl)methylene)pentane-2,4-dione
Alternate Name(s) 3-[[(2E)-2-[(4-bromophenyl)methylene]cyclopropyl]methylene]pentane-2,4-dione 3-[[(2E)-2-[(4-bromophenyl)methylidene]cyclopropyl]methylidene]pentane-2,4-dione
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Formula C16H15BrO2
InChI InChI=1S/C16H15BrO2/c1-10(18)16(11(2)19)9-14-8-13(14)7-12-3-5-15(17)6-4-12/h3-7,9,14H,8H2,1-2H3/b13-7+
InChIKey YMSKDYFBSKPAGS-NTUHNPAUSA-N
Literature Reference DOI 10.1021/ol102002f
Molecular Weight 319.198 g/mol
SMILES c1(ccc(\C=C/2CC2C=C(C(C)=O)C(=O)C)cc1)Br
SPLASH splash10-01bc-3709000000-2acba95793259491ecf1
Source of Spectrum A1-12-5120/SMS4-1b
Wiley ID 1752601