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(2Z,7Z)-2,7-bis(4-iodobenzylidene)cycloheptanone
SpectraBase Compound ID FZ3eFUjNryo
InChI InChI=1S/C21H18I2O/c22-19-9-5-15(6-10-19)13-17-3-1-2-4-18(21(17)24)14-16-7-11-20(23)12-8-16/h5-14H,1-4H2/b17-13-,18-14-
InChIKey WHZMKEWFJGMFQO-JTFWXBGUSA-N
Mol Weight 540.18 g/mol
Molecular Formula C21H18I2O
Exact Mass 539.944705 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4rrRBK6gx58
Name (2Z,7Z)-2,7-bis(4-iodobenzylidene)cycloheptanone
Alternate Name(s) (2Z,7Z)-2,7-bis[(4-iodophenyl)methylene]cycloheptanone (2Z,7Z)-2,7-bis[(4-iodophenyl)methylidene]-1-cycloheptanone (2Z,7Z)-2,7-bis[(4-iodophenyl)methylidene]cycloheptan-1-one
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Formula C21H18I2O
InChI InChI=1S/C21H18I2O/c22-19-9-5-15(6-10-19)13-17-3-1-2-4-18(21(17)24)14-16-7-11-20(23)12-8-16/h5-14H,1-4H2/b17-13-,18-14-
InChIKey WHZMKEWFJGMFQO-JTFWXBGUSA-N
Molecular Weight 540.183 g/mol
SMILES C1(\C(CCCC\C1=C/c1ccc(cc1)I)=C/c1ccc(cc1)I)=O
SPLASH splash10-0006-0950450000-5dcdf231bce94b68167b
Source of Spectrum K-2001-693-3
Wiley ID 1578697