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2C-T-28 N,N-bis(4-methylbenzyl)
SpectraBase Compound ID 3hYiHMsC2Ve
InChI InChI=1S/C29H36FNO2S/c1-22-6-10-24(11-7-22)20-31(21-25-12-8-23(2)9-13-25)16-14-26-18-28(33-4)29(19-27(26)32-3)34-17-5-15-30/h6-13,18-19H,5,14-17,20-21H2,1-4H3
InChIKey ULRNHTFGRJXGIT-UHFFFAOYSA-N
Mol Weight 481.7 g/mol
Molecular Formula C29H36FNO2S
Exact Mass 481.245079 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8GHqbnDvH2O
Name 2C-T-28 N,N-bis(4-methylbenzyl)
Classification Chemical
Copyright Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 481.245078738 u
Formula C29H36FNO2S
InChI InChI=1S/C29H36FNO2S/c1-22-6-10-24(11-7-22)20-31(21-25-12-8-23(2)9-13-25)16-14-26-18-28(33-4)29(19-27(26)32-3)34-17-5-15-30/h6-13,18-19H,5,14-17,20-21H2,1-4H3
InChIKey ULRNHTFGRJXGIT-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 481.670 g/mol
Nominal Mass 481 u
Quality 1000
Retention Index 3438
SMILES C1(=C(C=C(C(=C1)OC)SCCCF)OC)CCN(CC=1C=CC(=CC1)C)CC1=CC=C(C=C1)C
SPLASH splash10-052r-0590000000-abce043ac1f224a364f7
Source of Spectrum DigiLab GmbH (C) 2024
Synonyms N,N-Di((4-methylbenzyl)-2-(4-[(3-fluoropropyl)thio)]-2,5-dimethoxyphenyl)ethan-1-amine
Technique GC/MS
Wiley ID DD2024_025040