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5-HEXADECYN-2-ONE

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5-HEXADECYN-2-ONE
SpectraBase Compound ID 1upKP6aqnaf
InChI InChI=1S/C16H28O/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16(2)17/h3-11,14-15H2,1-2H3
InChIKey JRULNEBGYMRBIF-UHFFFAOYSA-N
Mol Weight 236.4 g/mol
Molecular Formula C16H28O
Exact Mass 236.214016 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 6XStZvoqjsP
Name 5-HEXADECYN-2-ONE
Compound Number 3D
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C16H28O
InChI InChI=1S/C16H28O/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16(2)17/h3-11,14-15H2,1-2H3
InChIKey JRULNEBGYMRBIF-UHFFFAOYSA-N
Literature Reference Author A.WUBE,J.D.GUZMAN,A.HUFNER,C.HOCHFELLNER,M.BLUNDER,R.BAUER,S .GIBBONS,S.BHAKTA,F.
Literature Reference Citation MOLECULES,17,8217(2012)
Literature Reference DOI 10.3390/molecules17078217
Molecular Weight 236.398 g/mol
Sample ID 1024
Solvent CDCl3