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2-Fluorobenzoic acid, 2-methoxy-4-fluoro-5-(ethoxysulfo)phenyl ester
SpectraBase Compound ID LklQCnmaB66
InChI InChI=1S/C16H14F2O5S/c1-3-22-24(20)15-9-14(13(21-2)8-12(15)18)23-16(19)10-6-4-5-7-11(10)17/h4-9H,3H2,1-2H3
InChIKey GWDAFUIEVNVVQQ-UHFFFAOYSA-N
Mol Weight 356.34 g/mol
Molecular Formula C16H14F2O5S
Exact Mass 356.053001 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3OMfoHon6ZE
Name 2-Fluorobenzoic acid, 2-methoxy-4-fluoro-5-(ethoxysulfo)phenyl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H14F2O5S
InChI InChI=1S/C16H14F2O5S/c1-3-22-24(20)15-9-14(13(21-2)8-12(15)18)23-16(19)10-6-4-5-7-11(10)17/h4-9H,3H2,1-2H3
InChIKey GWDAFUIEVNVVQQ-UHFFFAOYSA-N
Molecular Weight 356.340 g/mol
SMILES c1(ccccc1F)C(=O)Oc1c(cc(c(c1)S(=O)OCC)F)OC
SPLASH splash10-00di-2900000000-2c5479e0aa1b7f4f1584
Source of Spectrum TIPS-2023-66-0
Wiley ID 1884774