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Acetamide, 2-phenylthio-N-decyl-

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Acetamide, 2-phenylthio-N-decyl-
SpectraBase Compound ID FsO8lGmwUwA
InChI InChI=1S/C18H29NOS/c1-2-3-4-5-6-7-8-12-15-19-18(20)16-21-17-13-10-9-11-14-17/h9-11,13-14H,2-8,12,15-16H2,1H3,(H,19,20)
InChIKey HPCPZGFWQJGRCB-UHFFFAOYSA-N
Mol Weight 307.5 g/mol
Molecular Formula C18H29NOS
Exact Mass 307.196986 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID AmhISeHRunG
Name Acetamide, 2-phenylthio-N-decyl-
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 307.196985731 u
Formula C18H29NOS
InChI InChI=1S/C18H29NOS/c1-2-3-4-5-6-7-8-12-15-19-18(20)16-21-17-13-10-9-11-14-17/h9-11,13-14H,2-8,12,15-16H2,1H3,(H,19,20)
InChIKey HPCPZGFWQJGRCB-UHFFFAOYSA-N
Molecular Weight 307.496 g/mol
SMILES C(=O)(NCCCCCCCCCC)CSC1=CC=CC=C1
Spectrum/Structure Validation Score (Vapor Phase IR) 0.842638