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2C-5-TOET N,N-bis(3-fluorobenzyl)
SpectraBase Compound ID 7xN6qktdf0f
InChI InChI=1S/C26H29F2NOS/c1-4-21-15-25(30-2)22(16-26(21)31-3)11-12-29(17-19-7-5-9-23(27)13-19)18-20-8-6-10-24(28)14-20/h5-10,13-16H,4,11-12,17-18H2,1-3H3
InChIKey OLTLOKVGOZMGOU-UHFFFAOYSA-N
Mol Weight 441.58 g/mol
Molecular Formula C26H29F2NOS
Exact Mass 441.193792 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7NRKivITPld
Name 2C-5-TOET N,N-bis(3-fluorobenzyl)
Classification Phenethylamine designer drug derivative
Copyright Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 441.193792057 u
Formula C26H29F2NOS
InChI InChI=1S/C26H29F2NOS/c1-4-21-15-25(30-2)22(16-26(21)31-3)11-12-29(17-19-7-5-9-23(27)13-19)18-20-8-6-10-24(28)14-20/h5-10,13-16H,4,11-12,17-18H2,1-3H3
InChIKey OLTLOKVGOZMGOU-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 441.581 g/mol
Nominal Mass 441 u
Quality 822
Retention Index 3016
SMILES C=1(C(=CC(=C(C1)SC)CC)OC)CCN(CC=1C=C(C=CC1)F)CC=1C=C(C=CC1)F
SPLASH splash10-0a4j-1940000000-f742503115238dc84cfc
Source of Spectrum DigiLab GmbH (C) 2024
Synonyms N,N-Bis(3-fluorobenzyl)-4-ethyl-2-methoxy-5-methylthiophenethylamine 2-(4-ethyl-2-methoxy-5-methylthiophenyl)-N,N-bis(3-fluorobenzyl)ethan-1-amine
Technique GC/MS
Wiley ID DD2024_021106