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Acetamide, 2-phenylthio-N-butyl-

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

Acetamide, 2-phenylthio-N-butyl-
SpectraBase Compound ID IdQQxqJhhWc
InChI InChI=1S/C12H17NOS/c1-2-3-9-13-12(14)10-15-11-7-5-4-6-8-11/h4-8H,2-3,9-10H2,1H3,(H,13,14)
InChIKey RGLKVTROGVNRBI-UHFFFAOYSA-N
Mol Weight 223.33 g/mol
Molecular Formula C12H17NOS
Exact Mass 223.103085 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID ClG9j6Kaqqa
Name Acetamide, 2-phenylthio-N-butyl-
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 223.103085344 u
Formula C12H17NOS
InChI InChI=1S/C12H17NOS/c1-2-3-9-13-12(14)10-15-11-7-5-4-6-8-11/h4-8H,2-3,9-10H2,1H3,(H,13,14)
InChIKey RGLKVTROGVNRBI-UHFFFAOYSA-N
Molecular Weight 223.334 g/mol
SMILES C(=O)(NCCCC)CSC1=CC=CC=C1
Spectrum/Structure Validation Score (Vapor Phase IR) 0.913601