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THIOBINUPHARIDINE, BIS(IODOMETHYLATE) (ISOMER 1)
SpectraBase Compound ID 4cozPi2O71P
InChI InChI=1S/C32H48N2O2S.2HI/c1-23-5-7-29(25-11-15-35-17-25)33(3)20-31(13-9-27(23)33)19-32(37-22-31)14-10-28-24(2)6-8-30(34(28,4)21-32)26-12-16-36-18-26;;/h11-12,15-18,23-24,27-30H,5-10,13-14,19-22H2,1-4H3;2*1H/q+2;;/p-2/t23-,24-,27+,28+,29+,30+,31-,32-,33-,34-;;/m0../s1
InChIKey OGUZEKXPMYKGKX-HSHNPPRTSA-L
Mol Weight 778.61695 g/mol
Molecular Formula C32H48I2N2O2S
Exact Mass 778.15259 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 3mFUc6XStSs
Name THIOBINUPHARIDINE, BIS(IODOMETHYLATE) (ISOMER 1)
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C32H48I2N2O2S
InChI InChI=1S/C32H48N2O2S.2HI/c1-23-5-7-29(25-11-15-35-17-25)33(3)20-31(13-9-27(23)33)19-32(37-22-31)14-10-28-24(2)6-8-30(34(28,4)21-32)26-12-16-36-18-26;;/h11-12,15-18,23-24,27-30H,5-10,13-14,19-22H2,1-4H3;2*1H/q+2;;/p-2/t23-,24-,27+,28+,29+,30+,31-,32-,33-,34-;;/m0../s1
InChIKey OGUZEKXPMYKGKX-HSHNPPRTSA-L
Instrument Name Varian CFT-20
Literature Reference JACEK CYBULSKI, JANUSZ JURCZAK, KRYSTYNA WOJTASIEWICZ, JERZY T. WROBEL (1982)Bull. Polish Acad. Sci. (Chemistry): v.30, N1, 31-36.
NMR Standard not reported
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CD4O methanol-d4