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AHLJWTIZANNAJL-UHFFFAOYSA-M

View entire compound with spectra: 1 NMR

AHLJWTIZANNAJL-UHFFFAOYSA-M
SpectraBase Compound ID BTDiyLKvQWh
InChI InChI=1S/C29H25NO2P.CHF3O3S/c1-2-31-29-28(30-27(32-29)23-15-7-3-8-16-23)33(24-17-9-4-10-18-24,25-19-11-5-12-20-25)26-21-13-6-14-22-26;2-1(3,4)8(5,6)7/h3-22H,2H2,1H3;(H,5,6,7)/q+1;/p-1
InChIKey AHLJWTIZANNAJL-UHFFFAOYSA-M
Mol Weight 599.56 g/mol
Molecular Formula C30H25F3NO5PS
Exact Mass 599.114316 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 1xwVTRMPnpL
Name AHLJWTIZANNAJL-UHFFFAOYSA-M
Compound Number 5AI
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C30H25F3NO5PS
InChI InChI=1S/C29H25NO2P.CHF3O3S/c1-2-31-29-28(30-27(32-29)23-15-7-3-8-16-23)33(24-17-9-4-10-18-24,25-19-11-5-12-20-25)26-21-13-6-14-22-26;2-1(3,4)8(5,6)7/h3-22H,2H2,1H3;(H,5,6,7)/q+1;/p-1
InChIKey AHLJWTIZANNAJL-UHFFFAOYSA-M
Literature Reference Author R.MAZURKIEWICZ,A.W.PIERWOCHA
Literature Reference Citation MH.CHEM.,128,893(1997)
Literature Reference DOI 10.1007/BF00807098
Molecular Weight 599.561 g/mol
Solvent CDCl3
Source File Reference UWRK3316