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(4-iso-Propylthio-2,5-dimethoxyphenyl)butan-2-amine TFA
SpectraBase Compound ID 9X07HK2AWuq
InChI InChI=1S/C17H24F3NO3S/c1-6-12(21-16(22)17(18,19)20)7-11-8-14(24-5)15(25-10(2)3)9-13(11)23-4/h8-10,12H,6-7H2,1-5H3,(H,21,22)
InChIKey PTHIFAZVJUGGAG-UHFFFAOYSA-N
Mol Weight 379.44 g/mol
Molecular Formula C17H24F3NO3S
Exact Mass 379.142899 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JIOtaQ9bspc
Name (4-iso-Propylthio-2,5-dimethoxyphenyl)butan-2-amine TFA
Classification Designer drug analog derivative
Copyright Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 379.142899297 u
Formula C17H24F3NO3S
InChI InChI=1S/C17H24F3NO3S/c1-6-12(21-16(22)17(18,19)20)7-11-8-14(24-5)15(25-10(2)3)9-13(11)23-4/h8-10,12H,6-7H2,1-5H3,(H,21,22)
InChIKey PTHIFAZVJUGGAG-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 379.438 g/mol
Nominal Mass 379 u
Quality 969
Retention Index 2743
SMILES C=1(C(=CC(=C(C1)OC)SC(C)C)OC)CC(NC(C(F)(F)F)=O)CC
SPLASH splash10-004l-8982000000-da78489303a248a1c614
Source of Spectrum DigiLab GmbH (C) 2024
Synonyms N-(1-(2,5-dimethoxy-4-(propan-2-ylsulfanyl)phenyl)butan-2-yl)(trifluoro)acetamide
Technique GC/MS
Wiley ID DD2024_008738