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2'-aminophenyl 3-(trifluoromethyl)benzenesulfonate
SpectraBase Compound ID D1RT8qA5Hux
InChI InChI=1S/C13H10F3NO3S/c14-13(15,16)9-4-3-5-10(8-9)21(18,19)20-12-7-2-1-6-11(12)17/h1-8H,17H2
InChIKey UNZWTBRYMKMTOK-UHFFFAOYSA-N
Mol Weight 317.28 g/mol
Molecular Formula C13H10F3NO3S
Exact Mass 317.033349 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EjDacvgSk2k
Name 2'-aminophenyl 3-(trifluoromethyl)benzenesulfonate
CAS Registry Number 115562-37-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H10F3NO3S
InChI InChI=1S/C13H10F3NO3S/c14-13(15,16)9-4-3-5-10(8-9)21(18,19)20-12-7-2-1-6-11(12)17/h1-8H,17H2
InChIKey UNZWTBRYMKMTOK-UHFFFAOYSA-N
Molecular Weight 317.282 g/mol
SMILES Nc1c(OS(c2cc(C(F)(F)F)ccc2)(=O)=O)cccc1
SPLASH splash10-0a4i-0910000000-aae675baa32894f0729b
Source of Spectrum J-53-4671-22
Synonyms 2-Aminophenyl 3-(trifluoromethyl)benzenesulfonate
Wiley ID 1317502