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PGRXNUUYZLEPRP-UHFFFAOYSA-L

View entire compound with spectra: 2 NMR

PGRXNUUYZLEPRP-UHFFFAOYSA-L
SpectraBase Compound ID IL3HpNN74GI
InChI InChI=1S/C30H28I2.2CHF3O3S/c1-29(2)21-5-13-25(14-6-21)31-27-17-9-23(10-18-27)30(3,4)24-11-19-28(20-12-24)32-26-15-7-22(29)8-16-26;2*2-1(3,4)8(5,6)7/h5-20H,1-4H3;2*(H,5,6,7)/q+2;;/p-2
InChIKey PGRXNUUYZLEPRP-UHFFFAOYSA-L
Mol Weight 940.49 g/mol
Molecular Formula C32H28F6I2O6S2
Exact Mass 939.93209 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 5Atq0wCZv6K
Name PGRXNUUYZLEPRP-UHFFFAOYSA-L
Compound Number 13A
Copyright Copyright © 2016-2025 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C32H28F6I2O6S2
InChI InChI=1S/C30H28I2.2CHF3O3S/c1-29(2)21-5-13-25(14-6-21)31-27-17-9-23(10-18-27)30(3,4)24-11-19-28(20-12-24)32-26-15-7-22(29)8-16-26;2*2-1(3,4)8(5,6)7/h5-20H,1-4H3;2*(H,5,6,7)/q+2;;/p-2
InChIKey PGRXNUUYZLEPRP-UHFFFAOYSA-L
Literature Reference Author U.RADHAKRISHNAN,P.J.STANG
Literature Reference Citation J.ORG.CHEM.,68,9209(2003)
Literature Reference DOI 10.1021/jo030246x
Molecular Weight 940.490 g/mol
Solvent CD3OD
Source File Reference UWMS26361