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(E)-(4-Fluorostyryl)(3-((4-methoxyphenyl)thio)propyl)sulfane

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

(E)-(4-Fluorostyryl)(3-((4-methoxyphenyl)thio)propyl)sulfane
SpectraBase Compound ID BfqXVzJAV3x
InChI InChI=1S/C18H19FOS2/c1-20-17-7-9-18(10-8-17)22-13-2-12-21-14-11-15-3-5-16(19)6-4-15/h3-11,14H,2,12-13H2,1H3/b14-11+
InChIKey GAHKGMIPFWRMGC-SDNWHVSQSA-N
Mol Weight 334.47 g/mol
Molecular Formula C18H19FOS2
Exact Mass 334.086136 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID FhDfsDt6kqI
Name (E)-(4-Fluorostyryl)(3-((4-methoxyphenyl)thio)propyl)sulfane
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 334.086135742 u
Formula C18H19FOS2
InChI InChI=1S/C18H19FOS2/c1-20-17-7-9-18(10-8-17)22-13-2-12-21-14-11-15-3-5-16(19)6-4-15/h3-11,14H,2,12-13H2,1H3/b14-11+
InChIKey GAHKGMIPFWRMGC-SDNWHVSQSA-N
Molecular Weight 334.467 g/mol
SMILES C=1C=C(\C=C\SCCCSC2=CC=C(C=C2)OC)C=CC1F
Spectrum/Structure Validation Score (Vapor Phase IR) 0.840119