Debug Info

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C801F5zkgJB
spectrumID
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C801F5zkgJB
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analyticalTechnique
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13C NMR
analyticalTechniqueLongName
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13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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4-Methylpent-1-yn-3-one
SpectraBase Compound ID LHPFB1FlSLm
InChI InChI=1S/C6H8O/c1-4-6(7)5(2)3/h1,5H,2-3H3
InChIKey KLQCAVMGXXCQHN-UHFFFAOYSA-N
Mol Weight 96.13 g/mol
Molecular Formula C6H8O
Exact Mass 96.057515 g/mol
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13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID C801F5zkgJB
Name 4-methylpent-1-yn-3-one
Copyright Copyright © 2016-2025 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C6H8O
InChI InChI=1S/C6H8O/c1-4-6(7)5(2)3/h1,5H,2-3H3
InChIKey KLQCAVMGXXCQHN-UHFFFAOYSA-N
Literature Reference Author ORGANIC_CHEMISTRY_(NMR-DEPARTMENT);UNIVERSITY_MAINZ
Literature Reference Citation UNI_MAINZ,INTERNAL_DB(2006)
Molecular Weight 96.129 g/mol
Source File Reference MHKO10250
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