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(Phenylthio)acetic acid, 2-(diethylamino)ethyl ester

View entire compound with spectra: 1 NMR, 1 FTIR, and 1 Raman

(Phenylthio)acetic acid, 2-(diethylamino)ethyl ester
SpectraBase Compound ID FdVckc3aqAA
InChI InChI=1S/C14H21NO2S/c1-3-15(4-2)10-11-17-14(16)12-18-13-8-6-5-7-9-13/h5-9H,3-4,10-12H2,1-2H3
InChIKey NOEVBSWCHKBTHN-UHFFFAOYSA-N
Mol Weight 267.39 g/mol
Molecular Formula C14H21NO2S
Exact Mass 267.1293 g/mol

Raman Spectrum

Raman Spectrum

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SpectraBase Spectrum ID KrhPqsFJAFr
Name (Phenylthio)acetic acid, 2-(diethylamino)ethyl ester
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 267.129300092 u
Formula C14H21NO2S
InChI InChI=1S/C14H21NO2S/c1-3-15(4-2)10-11-17-14(16)12-18-13-8-6-5-7-9-13/h5-9H,3-4,10-12H2,1-2H3
InChIKey NOEVBSWCHKBTHN-UHFFFAOYSA-N
Molecular Weight 267.387 g/mol
SMILES C=1C=CC=CC1SCC(=O)OCCN(CC)CC
Spectrum/Structure Validation Score (Raman) 0.91755