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1-(2-Methoxyphenyl)-5-methyl-7-(methylthio)indane

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

1-(2-Methoxyphenyl)-5-methyl-7-(methylthio)indane
SpectraBase Compound ID BEhxqvuNp2I
InChI InChI=1S/C18H20OS/c1-12-10-13-8-9-15(18(13)17(11-12)20-3)14-6-4-5-7-16(14)19-2/h4-7,10-11,15H,8-9H2,1-3H3
InChIKey MYVPKZHRGORZNP-UHFFFAOYSA-N
Mol Weight 284.42 g/mol
Molecular Formula C18H20OS
Exact Mass 284.123486 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID CgzfJvEzF4e
Name 1-(2-Methoxyphenyl)-5-methyl-7-(methylthio)indane
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 284.123486437 u
Formula C18H20OS
InChI InChI=1S/C18H20OS/c1-12-10-13-8-9-15(18(13)17(11-12)20-3)14-6-4-5-7-16(14)19-2/h4-7,10-11,15H,8-9H2,1-3H3
InChIKey MYVPKZHRGORZNP-UHFFFAOYSA-N
SMILES C1(CCC=2C=C(C=C(C12)SC)C)C=1C(=CC=CC1)OC
Spectrum/Structure Validation Score (Vapor Phase IR) 0.829453