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2-Phenylselenenylestrone
SpectraBase Compound ID LqesydhdtKE
InChI InChI=1S/C24H26O2Se/c1-24-12-11-17-18(21(24)9-10-23(24)25)8-7-16-13-22(26-27)20(14-19(16)17)15-5-3-2-4-6-15/h2-6,13-14,17-18,21,27H,7-12H2,1H3/t17-,18+,21-,24-/m0/s1
InChIKey GBGGSLYNCMEWDF-QNJCZANYSA-N
Mol Weight 425.44 g/mol
Molecular Formula C24H26O2Se
Exact Mass 426.109802 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8FDrYOFwy9Q
Name 2-Phenylselenenylestrone
Alternate Name(s) 2-Phenyl-3-(selanyloxy)estra-1,3,5(10)-trien-17-one
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Formula C24H26O2Se
InChI InChI=1S/C24H26O2Se/c1-24-12-11-17-18(21(24)9-10-23(24)25)8-7-16-13-22(26-27)20(14-19(16)17)15-5-3-2-4-6-15/h2-6,13-14,17-18,21,27H,7-12H2,1H3/t17-,18+,21-,24-/m0/s1
InChIKey GBGGSLYNCMEWDF-QNJCZANYSA-N
Molecular Weight 425.442 g/mol
SMILES [SeH]Oc1cc2c([C@]3(CC[C@]4([C@]([C@@]3(CC2)[H])(CCC4=O)[H])C)[H])cc1-c1ccccc1
SPLASH splash10-00b9-0001900000-f225e872c881485d5940
Source of Spectrum KC-1991-270-2
Wiley ID 1379946