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(4-iso-Propylthio-2,5-dimethoxyphenyl)butan-2-amine HEX
SpectraBase Compound ID I3rpz7NzM1F
InChI InChI=1S/C21H35NO3S/c1-7-9-10-11-21(23)22-17(8-2)12-16-13-19(25-6)20(26-15(3)4)14-18(16)24-5/h13-15,17H,7-12H2,1-6H3,(H,22,23)
InChIKey NEVNUDLGOZPQGI-UHFFFAOYSA-N
Mol Weight 381.6 g/mol
Molecular Formula C21H35NO3S
Exact Mass 381.233765 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GU0o7Iyrke0
Name (4-iso-Propylthio-2,5-dimethoxyphenyl)butan-2-amine HEX
Classification Designer drug analog derivative
Copyright Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 381.233765162 u
Formula C21H35NO3S
InChI InChI=1S/C21H35NO3S/c1-7-9-10-11-21(23)22-17(8-2)12-16-13-19(25-6)20(26-15(3)4)14-18(16)24-5/h13-15,17H,7-12H2,1-6H3,(H,22,23)
InChIKey NEVNUDLGOZPQGI-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 381.575 g/mol
Nominal Mass 381 u
Quality 959
Retention Index 2790
SMILES C=1(C(=CC(=C(C1)OC)SC(C)C)OC)CC(NC(CCCCC)=O)CC
SPLASH splash10-0aou-9261000000-bf3759e88cb7f18d5def
Source of Spectrum DigiLab GmbH (C) 2024
Synonyms N-(1-(2,5-dimethoxy-4-(propan-2-ylsulfanyl)phenyl)butan-2-yl)hexanamide
Technique GC/MS
Wiley ID DD2024_008741