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Ethyl 3-[2-methyl-2-mercaptopropylamino]butyrate

View entire compound with spectra: 1 FTIR

Ethyl 3-[2-methyl-2-mercaptopropylamino]butyrate
SpectraBase Compound ID ETJtOpYMgfy
InChI InChI=1S/C10H21NO2S/c1-5-13-9(12)6-8(2)11-7-10(3,4)14/h8,11,14H,5-7H2,1-4H3
InChIKey BWILOSAFHHIWNI-UHFFFAOYSA-N
Mol Weight 219.34 g/mol
Molecular Formula C10H21NO2S
Exact Mass 219.1293 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID JR2fbe4ypzq
Name Ethyl 3-[2-methyl-2-mercaptopropylamino]butyrate
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 219.129300092 u
Formula C10H21NO2S
InChI InChI=1S/C10H21NO2S/c1-5-13-9(12)6-8(2)11-7-10(3,4)14/h8,11,14H,5-7H2,1-4H3
InChIKey BWILOSAFHHIWNI-UHFFFAOYSA-N
Molecular Weight 219.343 g/mol
SMILES CC(S)(C)CNC(CC(OCC)=O)C
Spectrum/Structure Validation Score (Vapor Phase IR) 0.970143