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(2SR,4RS)-7-trifluoromethoxy-2-(5-methylthiophen-2-yl)-2,3,4,5-tetrahydro-1,4-epoxy-1-benzazepine
SpectraBase Compound ID 4WdzNqENyIK
InChI InChI=1S/C16H14F3NO2S/c1-9-2-5-15(23-9)14-8-12-7-10-6-11(21-16(17,18)19)3-4-13(10)20(14)22-12/h2-6,12,14H,7-8H2,1H3/t12-,14+/m0/s1
InChIKey WKDLXUQFVAYXPR-GXTWGEPZSA-N
Mol Weight 341.35 g/mol
Molecular Formula C16H14F3NO2S
Exact Mass 341.069734 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2EsQPSiIS7U
Name (2SR,4RS)-7-trifluoromethoxy-2-(5-methylthiophen-2-yl)-2,3,4,5-tetrahydro-1,4-epoxy-1-benzazepine
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H14F3NO2S
InChI InChI=1S/C16H14F3NO2S/c1-9-2-5-15(23-9)14-8-12-7-10-6-11(21-16(17,18)19)3-4-13(10)20(14)22-12/h2-6,12,14H,7-8H2,1H3/t12-,14+/m0/s1
InChIKey WKDLXUQFVAYXPR-GXTWGEPZSA-N
Literature Reference DOI 10.1016/j.ejmech.2014.08.055
Molecular Weight 341.348 g/mol
SMILES c12ccc(OC(F)(F)F)cc2C[C@@]2(ON1[C@@](c1sc(cc1)C)(C2)[H])[H]
SPLASH splash10-00dr-0902000000-1c9533d6807a776c5ee3
Source of Spectrum EMC-86-301-10n
Synonyms (1R,2S)-2-(5-methylthiophen-2-yl)-7-(trifluoromethoxy)-2,3,4,5-tetrahydro-1,4-epoxybenzo[b]azepine
Wiley ID 1748003