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8-Acetamido-1,1,1,15,15-pentachloropentadeca-3,12-diyne

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8-Acetamido-1,1,1,15,15-pentachloropentadeca-3,12-diyne
SpectraBase Compound ID J5NiUyVhMxW
InChI InChI=1S/C17H22Cl5NO/c1-14(24)23-15(10-6-2-3-8-12-16(18)19)11-7-4-5-9-13-17(20,21)22/h15-16H,2,4,6-7,10-13H2,1H3,(H,23,24)
InChIKey PHCUUSBWIFRVFM-UHFFFAOYSA-N
Mol Weight 433.6 g/mol
Molecular Formula C17H22Cl5NO
Exact Mass 431.014403 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 1AHTdJ5N2by
Name 8-ACETAMIDO-1,1,1,15,15-PENTACHLOROPENTADECA-3,12-DIYNE
Compound Number 1
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C17H22Cl5NO
InChI InChI=1S/C17H22Cl5NO/c1-14(24)23-15(10-6-2-3-8-12-16(18)19)11-7-4-5-9-13-17(20,21)22/h15-16H,2,4,6-7,10-13H2,1H3,(H,23,24)
InChIKey PHCUUSBWIFRVFM-UHFFFAOYSA-N
Literature Reference Author M.A.ORSINI,L.K.PANNELL,K.L.ERICKSON
Literature Reference Citation J.NAT.PROD.,64,572(2001)
Literature Reference DOI 10.1021/np000452p
Molecular Weight 433.633 g/mol
Solvent CDCl3