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3-Hepten-2-one
SpectraBase Compound ID 9RWWTJIzRjo
InChI InChI=1S/C7H12O/c1-3-4-5-6-7(2)8/h5-6H,3-4H2,1-2H3/b6-5+
InChIKey JHHZQADGLDKIPM-AATRIKPKSA-N
Mol Weight 112.17 g/mol
Molecular Formula C7H12O
Exact Mass 112.088815 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 8aJST4jwO3Q
Name trans-3-HEPTEN-2-ONE
Source of Sample Tokyo Kasei Kogyo Company, Ltd., Tokyo, Japan
Copyright Copyright © 1991-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C7H12O
InChI InChI=1S/C7H12O/c1-3-4-5-6-7(2)8/h5-6H,3-4H2,1-2H3/b6-5+
InChIKey JHHZQADGLDKIPM-AATRIKPKSA-N
Instrument Name BRUKER AC-300
Molecular Weight 112.17
Solvent CDCl3; Reference=TMS; Temperature 297K