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2-Trifluoroacetyl-1-(4-iodophenylamino)-cycloheptene
SpectraBase Compound ID 3xZHobo6USM
InChI InChI=1S/C15H15F3INO/c16-15(17,18)14(21)12-4-2-1-3-5-13(12)20-11-8-6-10(19)7-9-11/h6-9,20H,1-5H2
InChIKey WFYRACJBJRVBBE-UHFFFAOYSA-N
Mol Weight 409.19 g/mol
Molecular Formula C15H15F3INO
Exact Mass 409.015044 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CTG9Pa6Hn1A
Name 2-Trifluoroacetyl-1-(4-iodophenylamino)-cycloheptene
Appearance Yellow solid
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Formula C15H15F3INO
InChI InChI=1S/C15H15F3INO/c16-15(17,18)14(21)12-4-2-1-3-5-13(12)20-11-8-6-10(19)7-9-11/h6-9,20H,1-5H2
InChIKey WFYRACJBJRVBBE-UHFFFAOYSA-N
Instrument Name HP 6890-5973
Ionization Type EI
Literature Reference DOI 10.3998/ark.5550190.0009.g07
Molecular Weight 409.191 g/mol
SMILES N(C1=C(C(=O)C(F)(F)F)CCCCC1)c1ccc(cc1)I
SPLASH splash10-0a59-3724900000-92e85a6b4a031b1ad076
Source of Spectrum ARK-2008-81-4f
Wiley ID 1869337