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2C-5-TOET 4-propylbenzoyl
SpectraBase Compound ID 8zvf3cgGN6Y
InChI InChI=1S/C22H29NO2S/c1-5-7-16-8-10-18(11-9-16)22(24)23-13-12-19-15-21(26-4)17(6-2)14-20(19)25-3/h8-11,14-15H,5-7,12-13H2,1-4H3,(H,23,24)
InChIKey XBILTSPQTJMDFM-UHFFFAOYSA-N
Mol Weight 371.54 g/mol
Molecular Formula C22H29NO2S
Exact Mass 371.1919 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DnuvhOUkSn2
Name 2C-5-TOET 4-propylbenzoyl
Classification Aminoethylthiophene designer drug
Copyright Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 371.191900350 u
Formula C22H29NO2S
InChI InChI=1S/C22H29NO2S/c1-5-7-16-8-10-18(11-9-16)22(24)23-13-12-19-15-21(26-4)17(6-2)14-20(19)25-3/h8-11,14-15H,5-7,12-13H2,1-4H3,(H,23,24)
InChIKey XBILTSPQTJMDFM-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 371.539 g/mol
Nominal Mass 371 u
Quality 750
Retention Index 2744
SMILES C=1(C(=CC(=C(C1)SC)CC)OC)CCNC(C=1C=CC(=CC1)CCC)=O
SPLASH splash10-0a4i-1693000000-990c58c89a0b33256e62
Source of Spectrum DigiLab GmbH (C) 2024
Synonyms N-(2-[4-Ethyl-2-methoxy-5-methylthiophenyl]ethyl)-4-propylbenzamide
Technique GC/MS
Wiley ID DD2024_023365