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IFYXNBDZGCIDOO-UHFFFAOYSA-N
SpectraBase Compound ID GtL20PKhacT
InChI InChI=1S/C27H15Cl4N3O2/c28-20-7-3-16(10-22(20)30)26(35)32-18-5-1-14-9-15-2-6-19(13-25(15)34-24(14)12-18)33-27(36)17-4-8-21(29)23(31)11-17/h1-13H,(H,32,35)(H,33,36)
InChIKey IFYXNBDZGCIDOO-UHFFFAOYSA-N
Mol Weight 555.2 g/mol
Molecular Formula C27H15Cl4N3O2
Exact Mass 552.991838 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID HQlkV4Fpj1E
Name IFYXNBDZGCIDOO-UHFFFAOYSA-N
Compound Number 7
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C27H15Cl4N3O2
InChI InChI=1S/C27H15Cl4N3O2/c28-20-7-3-16(10-22(20)30)26(35)32-18-5-1-14-9-15-2-6-19(13-25(15)34-24(14)12-18)33-27(36)17-4-8-21(29)23(31)11-17/h1-13H,(H,32,35)(H,33,36)
InChIKey IFYXNBDZGCIDOO-UHFFFAOYSA-N
Literature Reference Author Y.BENCHABANE,G.BOYER,R.FAURE
Literature Reference Citation MAGN.RES.CHEM.,47,706(2009)
Literature Reference DOI 10.1002/mrc.2441
Molecular Weight 555.247 g/mol
Solvent DMSO-D6
Source File Reference UWLU79860