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2,3-Dihydroxy-5-(2-fluorobenzoyl)benzonitrile
SpectraBase Compound ID HpMThqWJDYt
InChI InChI=1S/C14H8FNO3/c15-11-4-2-1-3-10(11)13(18)8-5-9(7-16)14(19)12(17)6-8/h1-6,17,19H
InChIKey ZSTLBCUHYUTGRS-UHFFFAOYSA-N
Mol Weight 257.22 g/mol
Molecular Formula C14H8FNO3
Exact Mass 257.048821 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AJ91KZy3vOg
Name 2,3-Dihydroxy-5-(2-fluorobenzoyl)benzonitrile
CAS Registry Number 125629-17-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H8FNO3
InChI InChI=1S/C14H8FNO3/c15-11-4-2-1-3-10(11)13(18)8-5-9(7-16)14(19)12(17)6-8/h1-6,17,19H
InChIKey ZSTLBCUHYUTGRS-UHFFFAOYSA-N
Molecular Weight 257.220 g/mol
SMILES Oc1c(c(cc(c1)C(c1c(F)cccc1)=O)C#N)O
SPLASH splash10-08mi-1940000000-36b7f92bc5e936779b38
Source of Spectrum H-72-967-35
Synonyms 5-(2-fluorobenzoyl)-2,3-dihydroxy-benzonitrile 5-(2-fluorophenyl)carbonyl-2,3-bis(oxidanyl)benzenecarbonitrile 5-[(2-fluorophenyl)-oxomethyl]-2,3-dihydroxybenzonitrile Benzonitrile, 2,3-dihydroxy-5-(2-fluorobenzoyl)-
Wiley ID 1260743