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(2E)-2-(4-fluorobenzylidene)dec-3-ynoic acid methyl ester
SpectraBase Compound ID 9zo3IO3j726
InChI InChI=1S/C18H21FO2/c1-3-4-5-6-7-8-9-16(18(20)21-2)14-15-10-12-17(19)13-11-15/h10-14H,3-7H2,1-2H3/b16-14+
InChIKey BQTBNTYASBUHEC-JQIJEIRASA-N
Mol Weight 288.36 g/mol
Molecular Formula C18H21FO2
Exact Mass 288.152558 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LujRNPRCXOG
Name (2E)-2-(4-fluorobenzylidene)dec-3-ynoic acid methyl ester
Alternate Name(s) (2E)-2-[(4-fluorophenyl)methylidene]-3-decynoic acid methyl ester Methyl (2E)-2-[(4-fluorophenyl)methylene]dec-3-ynoate Methyl (2E)-2-[(4-fluorophenyl)methylidene]dec-3-ynoate
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Formula C18H21FO2
InChI InChI=1S/C18H21FO2/c1-3-4-5-6-7-8-9-16(18(20)21-2)14-15-10-12-17(19)13-11-15/h10-14H,3-7H2,1-2H3/b16-14+
InChIKey BQTBNTYASBUHEC-JQIJEIRASA-N
Molecular Weight 288.362 g/mol
SMILES C(\C(C(=O)OC)=C/c1ccc(cc1)F)#CCCCCCC
SPLASH splash10-0a4i-6940000000-53ab6c6d82ddccff0305
Source of Spectrum PS-54-146-19
Wiley ID 805182