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1,4-Methanophenanthren-9(1H)-one, 2,3,4,4a,10,10a-hexahydro-8-iodo-, (1.alpha.,4.alpha.,4a.beta.,10a.beta.)-
SpectraBase Compound ID 7aHhX7qhzks
InChI InChI=1S/C15H15IO/c16-12-3-1-2-10-14-9-5-4-8(6-9)11(14)7-13(17)15(10)12/h1-3,8-9,11,14H,4-7H2/t8-,9+,11+,14+/m0/s1
InChIKey RFSGYIOQWYBKTL-AUDJIGTPSA-N
Mol Weight 338.19 g/mol
Molecular Formula C15H15IO
Exact Mass 338.01676 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 98RgOdjKHbf
Name 1,4-Methanophenanthren-9(1H)-one, 2,3,4,4a,10,10a-hexahydro-8-iodo-, (1.alpha.,4.alpha.,4a.beta.,10a.beta.)-
Alternate Name(s) (1R,2S,11R,12S)-7-iodotetracyclo[10.2.1.0(2,11).0(3,8)]pentadeca-3,5,7-trien-9-one
CAS Registry Number 124286-48-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H15IO
InChI InChI=1S/C15H15IO/c16-12-3-1-2-10-14-9-5-4-8(6-9)11(14)7-13(17)15(10)12/h1-3,8-9,11,14H,4-7H2/t8-,9+,11+,14+/m0/s1
InChIKey RFSGYIOQWYBKTL-AUDJIGTPSA-N
Molecular Weight 338.188 g/mol
SMILES [C@@]12([C@@](c3cccc(c3C(C2)=O)I)([C@@]2([H])C[C@@]1(CC2)[H])[H])[H]
SPLASH splash10-00dr-0696000000-3e3243bfb53f2b58fe84
Source of Spectrum J-55-1086-11
Wiley ID 1333460