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1-(4-(2-(1,3-dioxanyl)phenyl)-2,2,2-trifluoro-1-ethanone O-(p-tolylsulfonyl)oxime
SpectraBase Compound ID 9e1TZHpCfPs
InChI InChI=1S/C19H18F3NO5S/c1-13-3-9-16(10-4-13)29(24,25)28-23-17(19(20,21)22)14-5-7-15(8-6-14)18-26-11-2-12-27-18/h3-10,18H,2,11-12H2,1H3/b23-17+
InChIKey GJSFRGHBWDKPEI-HAVVHWLPSA-N
Mol Weight 429.41 g/mol
Molecular Formula C19H18F3NO5S
Exact Mass 429.085778 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5vCecUa8bDU
Name 1-(4-(2-(1,3-dioxanyl)phenyl)-2,2,2-trifluoro-1-ethanone O-(p-tolylsulfonyl)oxime
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H18F3NO5S
InChI InChI=1S/C19H18F3NO5S/c1-13-3-9-16(10-4-13)29(24,25)28-23-17(19(20,21)22)14-5-7-15(8-6-14)18-26-11-2-12-27-18/h3-10,18H,2,11-12H2,1H3/b23-17+
InChIKey GJSFRGHBWDKPEI-HAVVHWLPSA-N
Molecular Weight 429.410 g/mol
SMILES C(\C(=N\OS(c1ccc(cc1)C)(=O)=O)c1ccc(C2OCCCO2)cc1)(F)(F)F
SPLASH splash10-03di-1090000000-cf82e297ca6843ba5b7e
Source of Spectrum C-115-3470-5
Synonyms (E)-{1-[4-(1,3-dioxan-2-yl)phenyl]-2,2,2-trifluoroethylidene}amino 4-methylbenzene-1-sulfonate
Wiley ID 1381116