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acetic acid (3-chloro-4-keto-pentyl) ester
SpectraBase Compound ID LVDmyQeRVx1
InChI InChI=1S/C7H11ClO3/c1-5(9)7(8)3-4-11-6(2)10/h7H,3-4H2,1-2H3
InChIKey LQKQGYIKTRJVJF-UHFFFAOYSA-N
Mol Weight 178.61 g/mol
Molecular Formula C7H11ClO3
Exact Mass 178.039672 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID KOktdQH9YKL
Name 3-Chloro-5-acetoxy-2-pentanone
CAS Registry Number 13051-49-5
Copyright Copyright © 2002-2025 Wiley-VCH GmbH. All Rights Reserved.
Formula C7H11ClO3
InChI InChI=1S/C7H11ClO3/c1-5(9)7(8)3-4-11-6(2)10/h7H,3-4H2,1-2H3
InChIKey LQKQGYIKTRJVJF-UHFFFAOYSA-N
Instrument Name Bruker AM-270
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3