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5-Hydroxy-4-bromo-2-hexenoic acid
SpectraBase Compound ID KTICOMGQOPw
InChI InChI=1S/C6H9BrO3/c1-4(8)5(7)2-3-6(9)10/h2-5,8H,1H3,(H,9,10)/b3-2+/t4-,5+/m0/s1
InChIKey GIGCCDQSBSABRX-CSCGYKLNSA-N
Mol Weight 209.04 g/mol
Molecular Formula C6H9BrO3
Exact Mass 207.973507 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JtkX4zxFShK
Name 5-Hydroxy-4-bromo-2-hexenoic acid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C6H9BrO3
InChI InChI=1S/C6H9BrO3/c1-4(8)5(7)2-3-6(9)10/h2-5,8H,1H3,(H,9,10)/b3-2+/t4-,5+/m0/s1
InChIKey GIGCCDQSBSABRX-CSCGYKLNSA-N
Molecular Weight 209.039 g/mol
SMILES OC(\C=C\[C@]([C@@](O)(C)[H])(Br)[H])=O
SPLASH splash10-01ot-3900000000-166c9ac7e86096d07d55
Source of Spectrum Y4-87-673-16
Synonyms (2E)-4-bromo-5-hydroxy-2-hexenoic acid (E)-(4R,5S)-4-Bromo-5-hydroxy-hex-2-enoic acid
Wiley ID 840465