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Methyl 5,5,5-trifluoro-4-(2-iodophenylimino)pent-2-ynoate
SpectraBase Compound ID 5kwy47hvi86
InChI InChI=1S/C12H7F3INO2/c1-19-11(18)7-6-10(12(13,14)15)17-9-5-3-2-4-8(9)16/h2-5H,1H3/b17-10-
InChIKey WBUMGHKWAAXKCI-YVLHZVERSA-N
Mol Weight 381.09 g/mol
Molecular Formula C12H7F3INO2
Exact Mass 380.947358 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID D9ySKzlkxT3
Name Methyl 5,5,5-trifluoro-4-(2-iodophenylimino)pent-2-ynoate
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Formula C12H7F3INO2
InChI InChI=1S/C12H7F3INO2/c1-19-11(18)7-6-10(12(13,14)15)17-9-5-3-2-4-8(9)16/h2-5H,1H3/b17-10-
InChIKey WBUMGHKWAAXKCI-YVLHZVERSA-N
Literature Reference DOI 10.1002/adsc.200900875
Molecular Weight 381.093 g/mol
SMILES C(C#C\C(C(F)(F)F)=N\c1c(cccc1)I)(=O)OC
SPLASH splash10-0w59-2059000000-d90afe1bb8aaf7200073
Source of Spectrum ASC-352-1296/SM9-1n
Synonyms (Z)-methyl 5,5,5-trifluoro-4-((2-iodophenyl)imino)pent-2-ynoate
Wiley ID 1764472