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Oestron sulfate anion
SpectraBase Compound ID IWF6pSoFJw5
InChI InChI=1S/C18H22O4S/c1-18-9-8-14-13-5-3-12(23(20,21)22)10-11(13)2-4-15(14)16(18)6-7-17(18)19/h3,5,10,14-16H,2,4,6-9H2,1H3,(H,20,21,22)/p-1
InChIKey HTCAJFKKABKRPB-UHFFFAOYSA-M
Mol Weight 333.42 g/mol
Molecular Formula C18H21O4S
Exact Mass 333.116055 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID cgx9wRYqSk
Name Oestron sulfate anion
Comments sodium salt
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Formula C18H21O4S
InChI InChI=1S/C18H22O4S/c1-18-9-8-14-13-5-3-12(23(20,21)22)10-11(13)2-4-15(14)16(18)6-7-17(18)19/h3,5,10,14-16H,2,4,6-9H2,1H3,(H,20,21,22)/p-1
InChIKey HTCAJFKKABKRPB-UHFFFAOYSA-M
Instrument Name Bruker WH-90
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent DMSO-D6