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2-Butenoic acid, 4,4-dibromo-2-(bromomethyl)-, (E)-
SpectraBase Compound ID 4JEhsJXLUFR
InChI InChI=1S/C5H5Br3O2/c6-2-3(5(9)10)1-4(7)8/h1,4H,2H2,(H,9,10)/b3-1-
InChIKey FOQGPOVKYFFWGR-IWQZZHSRSA-N
Mol Weight 336.81 g/mol
Molecular Formula C5H5Br3O2
Exact Mass 333.783968 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IN8UeGduWIS
Name 2-Butenoic acid, 4,4-dibromo-2-(bromomethyl)-, (E)-
Alternate Name(s) (2E)-4,4-dibromo-2-(bromomethyl)-2-butenoic acid Mixture of E and Z isomers of 4,4-dibromo-2-bromomethyl-2-butenoic acid
CAS Registry Number 58844-32-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C5H5Br3O2
InChI InChI=1S/C5H5Br3O2/c6-2-3(5(9)10)1-4(7)8/h1,4H,2H2,(H,9,10)/b3-1-
InChIKey FOQGPOVKYFFWGR-IWQZZHSRSA-N
Molecular Weight 336.805 g/mol
SMILES OC(\C(=C/C(Br)Br)CBr)=O
SPLASH splash10-056s-2950000000-195f199ac0a302518adb
Source of Spectrum H-59-105-7
Wiley ID 1330500