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(4-Nitrophenyl)(2-phenylprop-1-en-1-yl)sulfane

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

(4-Nitrophenyl)(2-phenylprop-1-en-1-yl)sulfane
SpectraBase Compound ID DpqE9UP1UNK
InChI InChI=1S/C15H13NO2S/c1-12(13-5-3-2-4-6-13)11-19-15-9-7-14(8-10-15)16(17)18/h2-11H,1H3
InChIKey JZQXXMLORVCFIV-UHFFFAOYSA-N
Mol Weight 271.33 g/mol
Molecular Formula C15H13NO2S
Exact Mass 271.0667 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 8jtX3Swa53z
Name (4-Nitrophenyl)(2-phenylprop-1-en-1-yl)sulfane
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 271.066699835 u
Formula C15H13NO2S
InChI InChI=1S/C15H13NO2S/c1-12(13-5-3-2-4-6-13)11-19-15-9-7-14(8-10-15)16(17)18/h2-11H,1H3
InChIKey JZQXXMLORVCFIV-UHFFFAOYSA-N
SMILES C(SC1=CC=C(C=C1)[N+]([O-])=O)=C(C1=CC=CC=C1)C
Spectrum/Structure Validation Score (Vapor Phase IR) 0.813725