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8-Acetamido-1,1,15,15-tetrachloropentadeca-3-yne
SpectraBase Compound ID G2FQfSx6YBf
InChI InChI=1S/C17H27Cl4NO/c1-14(23)22-15(10-6-2-4-8-12-16(18)19)11-7-3-5-9-13-17(20)21/h15-17H,2-4,6-8,10-13H2,1H3,(H,22,23)
InChIKey XXUGBSMDILTLJG-UHFFFAOYSA-N
Mol Weight 403.2 g/mol
Molecular Formula C17H27Cl4NO
Exact Mass 401.084675 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4DXM5xC0Dg
Name 8-Acetamido-1,1,15,15-tetrachloropentadeca-3-yne
Appearance oil
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H27Cl4NO
InChI InChI=1S/C17H27Cl4NO/c1-14(23)22-15(10-6-2-4-8-12-16(18)19)11-7-3-5-9-13-17(20)21/h15-17H,2-4,6-8,10-13H2,1H3,(H,22,23)
InChIKey XXUGBSMDILTLJG-UHFFFAOYSA-N
Instrument Name JEOL SX102
Ionization Type EI
Literature Reference DOI 10.1021/np000452p
Molecular Weight 403.221 g/mol
Optical Rotation [a]D = +24.0 (c = 0.083, CHCl3)
Reported Formula C17H27Cl4NO
SMILES N(C(C)=O)C(CCCC#CCC(Cl)Cl)CCCCCCC(Cl)Cl
SPLASH splash10-0002-9541000000-63555c62bd2e4fe43e50
Source of Spectrum G4-64-576-4
Wiley ID 1883127