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5-Oxoheptanoic acid

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5-Oxoheptanoic acid
SpectraBase Compound ID 79K2xbvz7n2
InChI InChI=1S/C7H12O3/c1-2-6(8)4-3-5-7(9)10/h2-5H2,1H3,(H,9,10)
InChIKey PHADZMIQVBXNAW-UHFFFAOYSA-N
Mol Weight 144.17 g/mol
Molecular Formula C7H12O3
Exact Mass 144.078644 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID L6lrtvBDszb
Name 5-OXOHEPTANOIC-ACID
Compound Number 2C
Copyright Copyright © 2016-2025 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C7H12O3
InChI InChI=1S/C7H12O3/c1-2-6(8)4-3-5-7(9)10/h2-5H2,1H3,(H,9,10)
InChIKey PHADZMIQVBXNAW-UHFFFAOYSA-N
Literature Reference Author Y.MATSUURA,W.CHAI,E.ENDOH,J.SUHARA,H.HAMADA,C.A.HORIUCHI
Literature Reference Citation PHYTOCHEM.,61,669(2002)
Literature Reference DOI 10.1016/S0031-9422(02)00373-4
Molecular Weight 144.170 g/mol
Solvent CDCl3
Source File Reference UWLU29426