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(+)-thioglycolic acid N[(R)-.alpha.-methylbenzyl]amide

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

(+)-thioglycolic acid N[(R)-.alpha.-methylbenzyl]amide
SpectraBase Compound ID EZQabFkYSPC
InChI InChI=1S/C10H13NOS/c1-8(11-10(12)7-13)9-5-3-2-4-6-9/h2-6,8,13H,7H2,1H3,(H,11,12)/t8-/m1/s1
InChIKey DLXHZNJMHZQLRT-MRVPVSSYSA-N
Mol Weight 195.28 g/mol
Molecular Formula C10H13NOS
Exact Mass 195.071785 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID KLz3SB25cqT
Name (+)-thioglycolic acid N[(R)-.alpha.-methylbenzyl]amide
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 195.071785216 u
Formula C10H13NOS
InChI InChI=1S/C10H13NOS/c1-8(11-10(12)7-13)9-5-3-2-4-6-9/h2-6,8,13H,7H2,1H3,(H,11,12)/t8-/m1/s1
InChIKey DLXHZNJMHZQLRT-MRVPVSSYSA-N
Molecular Weight 195.280 g/mol
SMILES C(N[C@@](C1=CC=CC=C1)(C)[H])(=O)CS
Spectrum/Structure Validation Score (Vapor Phase IR) 0.938302