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Benzamide, N-[3-(methylthio)propyl]-

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

Benzamide, N-[3-(methylthio)propyl]-
SpectraBase Compound ID 3ZtDhnbaJ0G
InChI InChI=1S/C11H15NOS/c1-14-9-5-8-12-11(13)10-6-3-2-4-7-10/h2-4,6-7H,5,8-9H2,1H3,(H,12,13)
InChIKey HPPUUNKNXGREKP-UHFFFAOYSA-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 Isb9hwKytSH
Name Benzamide, N-[3-(methylthio)propyl]-
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/c1-14-9-5-8-12-11(13)10-6-3-2-4-7-10/h2-4,6-7H,5,8-9H2,1H3,(H,12,13)
InChIKey HPPUUNKNXGREKP-UHFFFAOYSA-N
Molecular Weight 209.307 g/mol
SMILES C(=O)(C=1C=CC=CC1)NCCCSC
Spectrum/Structure Validation Score (Vapor Phase IR) 0.968319