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rel-(3aS,7aR,E)-1-(Iodomethylene)octahydro-1H-indene-3a-carbaldehyde
SpectraBase Compound ID CAw7eGSeaTn
InChI InChI=1S/C11H15IO/c12-7-9-4-6-11(8-13)5-2-1-3-10(9)11/h7-8,10H,1-6H2/b9-7+/t10-,11+/m0/s1
InChIKey IRNOWHFLYCIFPV-RZABIFLQSA-N
Mol Weight 290.14 g/mol
Molecular Formula C11H15IO
Exact Mass 290.01676 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 45529M3kNXG
Name rel-(3aS,7aR,E)-1-(Iodomethylene)octahydro-1H-indene-3a-carbaldehyde
Appearance Colorless oil
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Exact Mass 290.016760102 u
Formula C11H15IO
InChI InChI=1S/C11H15IO/c12-7-9-4-6-11(8-13)5-2-1-3-10(9)11/h7-8,10H,1-6H2/b9-7+/t10-,11+/m0/s1
InChIKey IRNOWHFLYCIFPV-RZABIFLQSA-N
Instrument Name GCMS
Ionization Type EI
Literature Reference DOI 10.1021/jo302751p
Molecular Weight 290.144 g/mol
Quality 249
Reported Formula C11H15OI
SMILES C1C[C@]2([C@@](CC1)(\C(CC2)=C\I)[H])C=O
SPLASH splash10-01ox-3970000000-0a4d91869ae9b76ae362
Source of Spectrum JOC-78-2783-6l (DOI: 10.1021/jo302751p)
Thin-Layer Chromatography 0.33 (pentanes/Et2O, 95:5)
Wiley ID 1912404