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(2R,6R)-2,6-Dibenzoyl-2-(m-chlorobenzoyloxy)selenane
SpectraBase Compound ID 2bcSBdTkMUi
InChI InChI=1S/C26H21ClO4Se/c27-21-14-7-13-20(17-21)25(30)31-26(24(29)19-11-5-2-6-12-19)16-8-15-22(32-26)23(28)18-9-3-1-4-10-18/h1-7,9-14,17,22H,8,15-16H2/t22-,26-/m1/s1
InChIKey RNJRLROHFJGBON-ATIYNZHBSA-N
Mol Weight 511.87 g/mol
Molecular Formula C26H21ClO4Se
Exact Mass 512.029359 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GsQ3SmEUC8U
Name (2R,6R)-2,6-Dibenzoyl-2-(m-chlorobenzoyloxy)selenane
Alternate Name(s) (2R,6R)-2,6-dibenzoyltetrahydro-2H-selenopyran-2-yl 3-chlorobenzoate cis-2,6-Dibenzoyl-2-(m-chlorobenzoyloxy)selenane
Comments Less than 3 mono-isotopic peaks
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Formula C26H21ClO4Se
InChI InChI=1S/C26H21ClO4Se/c27-21-14-7-13-20(17-21)25(30)31-26(24(29)19-11-5-2-6-12-19)16-8-15-22(32-26)23(28)18-9-3-1-4-10-18/h1-7,9-14,17,22H,8,15-16H2/t22-,26-/m1/s1
InChIKey RNJRLROHFJGBON-ATIYNZHBSA-N
Molecular Weight 511.875 g/mol
SMILES [C@]1([Se][C@@](C(=O)c2ccccc2)(CCC1)[H])(OC(c1cc(Cl)ccc1)=O)C(=O)c1ccccc1
SPLASH splash10-0a4i-0900000000-ad08d11c7f50d360c451
Source of Spectrum K-2001-534-5
Wiley ID 1578656