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5-(Iodomethyl)-3-phenyldihydrofuran-2(3H)-one
SpectraBase Compound ID CFTw5EnGV3c
InChI InChI=1S/C11H11IO2/c12-7-9-6-10(11(13)14-9)8-4-2-1-3-5-8/h1-5,9-10H,6-7H2/t9-,10+/m1/s1
InChIKey SAFAOXJEALUKEW-ZJUUUORDSA-N
Mol Weight 302.11 g/mol
Molecular Formula C11H11IO2
Exact Mass 301.980375 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 33wFoidPCnd
Name 5-(Iodomethyl)-3-phenyldihydrofuran-2(3H)-one
Comments Computed using HOSE algorithm
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Exact Mass 301.980374592 u
Formula C11H11IO2
InChI InChI=1S/C11H11IO2/c12-7-9-6-10(11(13)14-9)8-4-2-1-3-5-8/h1-5,9-10H,6-7H2/t9-,10+/m1/s1
InChIKey SAFAOXJEALUKEW-ZJUUUORDSA-N
Molecular Weight 302.111 g/mol
SMILES C1(O[C@@](CI)(C[C@]1(C=1C=CC=CC1)[H])[H])=O