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2C-T-28 N-(4-methylbenzyl)
SpectraBase Compound ID 4odNYb0YP2o
InChI InChI=1S/C21H28FNO2S/c1-16-5-7-17(8-6-16)15-23-11-9-18-13-20(25-3)21(14-19(18)24-2)26-12-4-10-22/h5-8,13-14,23H,4,9-12,15H2,1-3H3
InChIKey KAURASOEROEBTP-UHFFFAOYSA-N
Mol Weight 377.52 g/mol
Molecular Formula C21H28FNO2S
Exact Mass 377.182478 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GWx4DyzsUqG
Name 2C-T-28 N-(4-methylbenzyl)
Classification Chemical
Copyright Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 377.182478481 u
Formula C21H28FNO2S
InChI InChI=1S/C21H28FNO2S/c1-16-5-7-17(8-6-16)15-23-11-9-18-13-20(25-3)21(14-19(18)24-2)26-12-4-10-22/h5-8,13-14,23H,4,9-12,15H2,1-3H3
InChIKey KAURASOEROEBTP-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 377.518 g/mol
Nominal Mass 377 u
Quality 993
Retention Index 2819
SMILES C1(=C(C=C(C(=C1)OC)SCCCF)OC)CCNCC=1C=CC(=CC1)C
SPLASH splash10-0a4l-1940000000-aa7bdc123acce3bbfdc0
Source of Spectrum DigiLab GmbH (C) 2024
Synonyms 2-[4-(3-Fluoropropylthio)-2,5-dimethoxyphenyl]-N-(4methylbenzyl)ethan-1-amine
Technique GC/MS
Wiley ID DD2024_025039