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5-TOET-A (-H+O) PFP
SpectraBase Compound ID JpAGU1tx74s
InChI InChI=1S/C16H19F5O3S/c1-5-10-7-12(23-3)11(8-13(10)25-4)6-9(2)24-14(22)15(17,18)16(19,20)21/h7-9H,5-6H2,1-4H3
InChIKey RYYMVGBXPGXTNE-UHFFFAOYSA-N
Mol Weight 386.38 g/mol
Molecular Formula C16H19F5O3S
Exact Mass 386.097506 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2nh0bIOt2sS
Name 5-TOET-A (-H+O) PFP
Classification Designer drug derivative artifact
Copyright Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 386.097506458 u
Formula C16H19F5O3S
InChI InChI=1S/C16H19F5O3S/c1-5-10-7-12(23-3)11(8-13(10)25-4)6-9(2)24-14(22)15(17,18)16(19,20)21/h7-9H,5-6H2,1-4H3
InChIKey RYYMVGBXPGXTNE-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 386.377 g/mol
Nominal Mass 386 u
Quality 982
Retention Index 1711
SMILES C(C(F)(F)F)(C(OC(CC=1C(=CC(=C(C1)SC)CC)OC)C)=O)(F)F
SPLASH splash10-0079-1946000000-28af5d9f866742669114
Source of Spectrum DigiLab GmbH (C) 2024
Synonyms O-Pentafluoropropionyl-1-(4-ethyl-2-methoxy-5-methylthiomethylphenyl)isopropan-2-ol 1-(4-ethyl-2-methoxy-5-methylthiophenyl)propan-2-yl 2,2,3,3,3-pentafluoropropanoate
Technique GC/MS
Wiley ID DD2024_016861