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IINLNWOJHGWWAZ-UHFFFAOYSA-N

View entire compound with spectra: 1 NMR

IINLNWOJHGWWAZ-UHFFFAOYSA-N
SpectraBase Compound ID 9cf33Hwskhh
InChI InChI=1S/C21H21NO11S/c1-29-17(23)13-14(18(24)30-2)16(20(26)32-4)21(15(13)19(25)31-3)22(10-11-33-21)34(27,28)12-8-6-5-7-9-12/h5-9H,10-11H2,1-4H3
InChIKey IINLNWOJHGWWAZ-UHFFFAOYSA-N
Mol Weight 495.46 g/mol
Molecular Formula C21H21NO11S
Exact Mass 495.083532 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID DNFwXdNN9PO
Name IINLNWOJHGWWAZ-UHFFFAOYSA-N
Compound Number 17
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C21H21NO11S
InChI InChI=1S/C21H21NO11S/c1-29-17(23)13-14(18(24)30-2)16(20(26)32-4)21(15(13)19(25)31-3)22(10-11-33-21)34(27,28)12-8-6-5-7-9-12/h5-9H,10-11H2,1-4H3
InChIKey IINLNWOJHGWWAZ-UHFFFAOYSA-N
Literature Reference Author P.COUTURE,J.WARKENTIN
Literature Reference Citation CAN.J.CHEM.,75,1281(1997)
Literature Reference DOI 10.1139/v97-154
Molecular Weight 495.458 g/mol
Solvent CDCl3
Source File Reference UWCP2563