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VZOMMEORBIGCPU-UHFFFAOYSA-N
SpectraBase Compound ID 55itg4gYpPK
InChI InChI=1S/C5H9BrO4/c1-8-3-10-4(6)5(7)9-2/h4H,3H2,1-2H3
InChIKey VZOMMEORBIGCPU-UHFFFAOYSA-N
Mol Weight 213.03 g/mol
Molecular Formula C5H9BrO4
Exact Mass 211.968422 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID KXnUznu1ivt
Name [2-13C]-BROMOMETHOXYMETHOXYACETIC-ACID-METHYLESTER
Compound Number 5
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C5H9BrO4
InChI InChI=1S/C5H9BrO4/c1-8-3-10-4(6)5(7)9-2/h4H,3H2,1-2H3
InChIKey VZOMMEORBIGCPU-UHFFFAOYSA-N
Literature Reference Author H.HAO,J.SIELER,D.SICKER
Literature Reference Citation J.NAT.PROD.,65,466(2002)
Literature Reference DOI 10.1021/np0102455
Molecular Weight 213.028 g/mol
Solvent CDCl3
Source File Reference UWSI5535