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[(Ethylthio)methyl]thiocarbonyl-2,5-dimethoxybenzene

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

[(Ethylthio)methyl]thiocarbonyl-2,5-dimethoxybenzene
SpectraBase Compound ID IvjhX67pILv
InChI InChI=1S/C12H16O2S2/c1-4-16-8-12(15)10-7-9(13-2)5-6-11(10)14-3/h5-7H,4,8H2,1-3H3
InChIKey LEVCWWZOSPOFOJ-UHFFFAOYSA-N
Mol Weight 256.38 g/mol
Molecular Formula C12H16O2S2
Exact Mass 256.059172 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID ge3QTptXG7
Name [(Ethylthio)methyl]thiocarbonyl-2,5-dimethoxybenzene
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 256.059172101 u
Formula C12H16O2S2
InChI InChI=1S/C12H16O2S2/c1-4-16-8-12(15)10-7-9(13-2)5-6-11(10)14-3/h5-7H,4,8H2,1-3H3
InChIKey LEVCWWZOSPOFOJ-UHFFFAOYSA-N
Molecular Weight 256.378 g/mol
SMILES C=1(C(=CC=C(C1)OC)OC)C(=S)CSCC
Spectrum/Structure Validation Score (Vapor Phase IR) 0.969498