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DOTFE CS2
SpectraBase Compound ID 44slfAE6Nd0
InChI InChI=1S/C14H16F3NO2S/c1-9(18-8-21)4-10-5-13(20-3)11(6-12(10)19-2)7-14(15,16)17/h5-6,9H,4,7H2,1-3H3
InChIKey UQAWICLGXUOZBV-UHFFFAOYSA-N
Mol Weight 319.34 g/mol
Molecular Formula C14H16F3NO2S
Exact Mass 319.085384 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2lYm4D4L0fQ
Name DOTFE CS2
Classification Amphetamine designer drug derivative
Copyright Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 319.085384420 u
Formula C14H16F3NO2S
InChI InChI=1S/C14H16F3NO2S/c1-9(18-8-21)4-10-5-13(20-3)11(6-12(10)19-2)7-14(15,16)17/h5-6,9H,4,7H2,1-3H3
InChIKey UQAWICLGXUOZBV-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 319.342 g/mol
Nominal Mass 319 u
Quality 1000
Retention Index 1883
SMILES C1(=C(C=C(C(=C1)OC)CC(N=C=S)C)OC)CC(F)(F)F
SPLASH splash10-001i-2692000000-3c77f43c5bc62fdadb20
Source of Spectrum DigiLab GmbH (C) 2024
Synonyms 1-(2,5-Dimethoxy-4-(2,2,2-trifluoroethyl)phenyl)-2-isothiocyanatopropane
Technique GC/MS
Wiley ID DD2024_018971