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1-(4-Bromophenyl)-2-thiocyanatoethanone

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1-(4-Bromophenyl)-2-thiocyanatoethanone
SpectraBase Compound ID AalTPfOpByH
InChI InChI=1S/C9H6BrNOS/c10-8-3-1-7(2-4-8)9(12)5-13-6-11/h1-4H,5H2
InChIKey PIXLLQKMZXDTOU-UHFFFAOYSA-N
Mol Weight 256.12 g/mol
Molecular Formula C9H6BrNOS
Exact Mass 254.935348 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID CpupM24SRIp
Name 1-(4-BROMOPHENYL)-2-THIOCYANATOETHANONE
Compound Number 2
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C9H6BrNOS
InChI InChI=1S/C9H6BrNOS/c10-8-3-1-7(2-4-8)9(12)5-13-6-11/h1-4H,5H2
InChIKey PIXLLQKMZXDTOU-UHFFFAOYSA-N
Literature Reference Author M.A.AL-SHEIKH
Literature Reference Citation MOLECULES,13,2750(2008)
Literature Reference DOI 10.3390/molecules13112750
Molecular Weight 256.117 g/mol
Sample ID 56829
Solvent DMSO-D6