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2C-T-31 AC
SpectraBase Compound ID 1crP2DzI8ci
InChI InChI=1S/C20H22F3NO3S/c1-13(25)24-9-8-15-10-18(27-3)19(11-17(15)26-2)28-12-14-4-6-16(7-5-14)20(21,22)23/h4-7,10-11H,8-9,12H2,1-3H3,(H,24,25)
InChIKey JZRJISANXYUCGG-UHFFFAOYSA-N
Mol Weight 413.46 g/mol
Molecular Formula C20H22F3NO3S
Exact Mass 413.127249 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JI8l5KMkAZk
Name 2C-T-31 AC
Classification Phenethylamine designer drug derivative
Copyright Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 413.127249232 u
Formula C20H22F3NO3S
InChI InChI=1S/C20H22F3NO3S/c1-13(25)24-9-8-15-10-18(27-3)19(11-17(15)26-2)28-12-14-4-6-16(7-5-14)20(21,22)23/h4-7,10-11H,8-9,12H2,1-3H3,(H,24,25)
InChIKey JZRJISANXYUCGG-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 413.455 g/mol
Nominal Mass 413 u
Quality 969
Retention Index 2722
SMILES C1(=C(C=C(C(=C1)OC)CCNC(=O)C)OC)SCC=1C=CC(C(F)(F)F)=CC1
SPLASH splash10-0udl-4915100000-da842c89722fef870374
Source of Spectrum DigiLab GmbH (C) 2024
Synonyms N-Acetyl-2,5-dimethoxy-4-(4-trifluoromethyl)benzylthiophenethylamine N-(2-(2,5-dimethoxy-4-((4-(trifluoromethyl)benzyl)sulfanyl)phenyl)ethyl)acetamide
Technique GC/MS
Wiley ID DD2024_016548