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(2R)-2-Benzoylaminobutanethiol

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

(2R)-2-Benzoylaminobutanethiol
SpectraBase Compound ID KfBIsStjW3U
InChI InChI=1S/C11H15NOS/c1-2-10(8-14)12-11(13)9-6-4-3-5-7-9/h3-7,10,14H,2,8H2,1H3,(H,12,13)/t10-/m1/s1
InChIKey FUEWGVTVSDKSDV-SNVBAGLBSA-N
Mol Weight 209.31 g/mol
Molecular Formula C11H15NOS
Exact Mass 209.087435 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 1BooO8jAPYo
Name (2R)-2-Benzoylaminobutanethiol
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 209.087435280 u
Formula C11H15NOS
InChI InChI=1S/C11H15NOS/c1-2-10(8-14)12-11(13)9-6-4-3-5-7-9/h3-7,10,14H,2,8H2,1H3,(H,12,13)/t10-/m1/s1
InChIKey FUEWGVTVSDKSDV-SNVBAGLBSA-N
Molecular Weight 209.307 g/mol
SMILES C(=O)(C1=CC=CC=C1)N[C@@](CS)(CC)[H]
Spectrum/Structure Validation Score (Vapor Phase IR) 0.935615