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N-(1,1-Dimethyl-2-phenylthioethyl)-1-naphthamide

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

N-(1,1-Dimethyl-2-phenylthioethyl)-1-naphthamide
SpectraBase Compound ID CpDaikSg5Ee
InChI InChI=1S/C21H21NOS/c1-21(2,15-24-17-11-4-3-5-12-17)22-20(23)19-14-8-10-16-9-6-7-13-18(16)19/h3-14H,15H2,1-2H3,(H,22,23)
InChIKey SSJHUQQZMLRVER-UHFFFAOYSA-N
Mol Weight 335.47 g/mol
Molecular Formula C21H21NOS
Exact Mass 335.134385 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 2jIT3v5gRbY
Name N-(1,1-Dimethyl-2-phenylthioethyl)-1-naphthamide
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 335.134385473 u
Formula C21H21NOS
InChI InChI=1S/C21H21NOS/c1-21(2,15-24-17-11-4-3-5-12-17)22-20(23)19-14-8-10-16-9-6-7-13-18(16)19/h3-14H,15H2,1-2H3,(H,22,23)
InChIKey SSJHUQQZMLRVER-UHFFFAOYSA-N
Molecular Weight 335.465 g/mol
SMILES C(C1=C2C(C=CC=C2)=CC=C1)(NC(CSC=1C=CC=CC1)(C)C)=O
Spectrum/Structure Validation Score (Vapor Phase IR) 0.899939