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Acetic acid; zinc; hydrate
SpectraBase Compound ID Dlv2KtRy8nZ
InChI InChI=1S/6C2H4O2.O.4Zn/c6*1-2(3)4;;;;;/h6*1H3,(H,3,4);;;;;/q;;;;;;-2;4*+2/p-6
InChIKey JCPDISNOORFYFA-UHFFFAOYSA-H
Mol Weight 631.8 g/mol
Molecular Formula C12H18O13Zn4
Exact Mass 625.791309 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2zbjuJQ7ho
Name Acetic acid; zinc; hydrate
CAS Registry Number 12129-82-7
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H18O13Zn4
InChI InChI=1S/6C2H4O2.O.4Zn/c6*1-2(3)4;;;;;/h6*1H3,(H,3,4);;;;;/q;;;;;;-2;4*+2/p-6
InChIKey JCPDISNOORFYFA-UHFFFAOYSA-H
Molecular Weight 631.791 g/mol
SMILES C=1([O-][Zn+2]23[O-2]45[Zn+2]6([O]1)[O-]C(C)=[O][Zn+2]5([O-]C(=[O]2)C)[O]=C([O-][Zn+2]4([O-]C(C)=[O]6)[O]=C(C)[O-]3)C)C
SPLASH splash10-004i-1039308000-cebb0a72f3ae31be67f8
Source of Spectrum EP-4122-0-0
Synonyms Ethanoic acid;zinc;hydrate
Wiley ID 1411837