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Benzoic acid, 4-bromo-5-cyano-2-hydroxy-, ethyl ester
SpectraBase Compound ID FJMrhkrXR96
InChI InChI=1S/C10H8BrNO3/c1-2-15-10(14)7-3-6(5-12)8(11)4-9(7)13/h3-4,13H,2H2,1H3
InChIKey WQPALNDPQQACSY-UHFFFAOYSA-N
Mol Weight 270.08 g/mol
Molecular Formula C10H8BrNO3
Exact Mass 268.968756 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8iz3BIrzHgq
Name Benzoic acid, 4-bromo-5-cyano-2-hydroxy-, ethyl ester
CAS Registry Number 105290-54-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H8BrNO3
InChI InChI=1S/C10H8BrNO3/c1-2-15-10(14)7-3-6(5-12)8(11)4-9(7)13/h3-4,13H,2H2,1H3
InChIKey WQPALNDPQQACSY-UHFFFAOYSA-N
Molecular Weight 270.082 g/mol
SMILES Oc1c(cc(c(Br)c1)C#N)C(=O)OCC
SPLASH splash10-00fr-0090000000-6cce803cab38fd6fc7a4
Source of Spectrum AH-117-399-3
Synonyms 1-Bromo-3-hydroxy-4-ethoxycarbonyl-6-cyano-benzene Ethyl 4-bromo-3-cyano-6-hydroxybenzoate Ethyl 4-bromo-5-cyanosalicylate
Wiley ID 1272950