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2,5-Dimethoxy-4-methylthiophenethylamine prop

View entire compound with spectra: 1 FTIR, and 1 MS (GC)

2,5-Dimethoxy-4-methylthiophenethylamine prop
SpectraBase Compound ID CZ1OUt1qDDR
InChI InChI=1S/C14H21NO3S/c1-5-14(16)15-7-6-10-8-12(18-3)13(19-4)9-11(10)17-2/h8-9H,5-7H2,1-4H3,(H,15,16)
InChIKey ZTNIRAHQWXCQSP-UHFFFAOYSA-N
Mol Weight 283.39 g/mol
Molecular Formula C14H21NO3S
Exact Mass 283.124215 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 66yFL0NTYjC
Name 2,5-Dimethoxy-4-methylthiophenethylamine prop
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 283.124214711 u
Formula C14H21NO3S
InChI InChI=1S/C14H21NO3S/c1-5-14(16)15-7-6-10-8-12(18-3)13(19-4)9-11(10)17-2/h8-9H,5-7H2,1-4H3,(H,15,16)
InChIKey ZTNIRAHQWXCQSP-UHFFFAOYSA-N
SMILES C=1(C(=CC(=C(C1)OC)SC)OC)CCNC(CC)=O
Spectrum/Structure Validation Score (Vapor Phase IR) 0.927589