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2C-5-TOET N,N-bis(4-ethylbenzoyl)
SpectraBase Compound ID CDPUVgtzbf1
InChI InChI=1S/C30H35NO3S/c1-6-21-9-13-24(14-10-21)29(32)31(30(33)25-15-11-22(7-2)12-16-25)18-17-26-20-28(35-5)23(8-3)19-27(26)34-4/h9-16,19-20H,6-8,17-18H2,1-5H3
InChIKey FFFYQCRJBATXNK-UHFFFAOYSA-N
Mol Weight 489.7 g/mol
Molecular Formula C30H35NO3S
Exact Mass 489.233765 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2lpaPD7hk6S
Name 2C-5-TOET N,N-bis(4-ethylbenzoyl)
Classification Phenethylamine designer drug derivative
Copyright Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 489.233765162 u
Formula C30H35NO3S
InChI InChI=1S/C30H35NO3S/c1-6-21-9-13-24(14-10-21)29(32)31(30(33)25-15-11-22(7-2)12-16-25)18-17-26-20-28(35-5)23(8-3)19-27(26)34-4/h9-16,19-20H,6-8,17-18H2,1-5H3
InChIKey FFFYQCRJBATXNK-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 489.674 g/mol
Nominal Mass 489 u
Quality 998
Retention Index 4092
SMILES C(N(C(C=1C=CC(=CC1)CC)=O)CCC=1C(=CC(=C(C1)SC)CC)OC)(C=1C=CC(=CC1)CC)=O
SPLASH splash10-0a4i-1970100000-f9cf6e5c9ddbe81c223d
Source of Spectrum DigiLab GmbH (C) 2024
Synonyms N-4-Ethylbenzoyl-N-(2-[4-ethyl-2-methoxy-5-methylthiophenyl]ethyl)-4-ethylbenzamide
Technique GC/MS
Wiley ID DD2024_023938