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2-(5-Iodothiophen-2-yl)bicyclo[2.2.1]heptan-2-ol
SpectraBase Compound ID 5ePPo0wAdFZ
InChI InChI=1S/C11H13IOS/c12-10-4-3-9(14-10)11(13)6-7-1-2-8(11)5-7/h3-4,7-8,13H,1-2,5-6H2/t7-,8+,11-/m0/s1
InChIKey SCRPRUBYMXCXIV-RNSXUZJQSA-N
Mol Weight 320.19 g/mol
Molecular Formula C11H13IOS
Exact Mass 319.973181 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9uUOMT3UT4Y
Name 2-(5-Iodothiophen-2-yl)bicyclo[2.2.1]heptan-2-ol
Appearance Colorless liquid
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Exact Mass 319.973181212 u
Formula C11H13IOS
InChI InChI=1S/C11H13IOS/c12-10-4-3-9(14-10)11(13)6-7-1-2-8(11)5-7/h3-4,7-8,13H,1-2,5-6H2/t7-,8+,11-/m0/s1
InChIKey SCRPRUBYMXCXIV-RNSXUZJQSA-N
Instrument Name Finnigan MAT95Q or Finnigan MAT90
Ionization Type EI
Literature Reference DOI 10.1002/anie.201803961
Molecular Weight 320.188 g/mol
Quality 106
Reported Formula C11H13IOS
SMILES O[C@@]1([C@]2(C[C@@](C1)(CC2)[H])[H])C1=CC=C(S1)I
SPLASH splash10-00fr-0981000000-c6f81e8939793f65ed22
Source of Spectrum ACI-57-SM29-6g (DOI: 10.1002/anie.201803961)
Wiley ID 1893254