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1,2,3,4-Tetrahydro-1-naphthalenethiol, S-(2-methylpropionyl)-

View entire compound with spectra: 1 FTIR

1,2,3,4-Tetrahydro-1-naphthalenethiol, S-(2-methylpropionyl)-
SpectraBase Compound ID 1AzFTt4Q34i
InChI InChI=1S/C14H18OS/c1-10(2)14(15)16-13-9-5-7-11-6-3-4-8-12(11)13/h3-4,6,8,10,13H,5,7,9H2,1-2H3
InChIKey WTQHZJWOCZPXTM-UHFFFAOYSA-N
Mol Weight 234.36 g/mol
Molecular Formula C14H18OS
Exact Mass 234.107836 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 1bFPteDrKlG
Name 1,2,3,4-Tetrahydro-1-naphthalenethiol, S-(2-methylpropionyl)-
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 234.107836373 u
Formula C14H18OS
InChI InChI=1S/C14H18OS/c1-10(2)14(15)16-13-9-5-7-11-6-3-4-8-12(11)13/h3-4,6,8,10,13H,5,7,9H2,1-2H3
InChIKey WTQHZJWOCZPXTM-UHFFFAOYSA-N
Molecular Weight 234.357 g/mol
SMILES C1(SC(C(C)C)=O)CCCC=2C1=CC=CC2
Spectrum/Structure Validation Score (Vapor Phase IR) 0.889704