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Methyl 2-(p-phenylphenyl)-2-((2-methylphenyl)thio)-4-pentenoate

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

Methyl 2-(p-phenylphenyl)-2-((2-methylphenyl)thio)-4-pentenoate
SpectraBase Compound ID E4grK79o1UP
InChI InChI=1S/C25H24O2S/c1-4-18-25(24(26)27-3,28-23-13-9-8-10-19(23)2)22-16-14-21(15-17-22)20-11-6-5-7-12-20/h4-17H,1,18H2,2-3H3
InChIKey JAYJKEVPYKKRME-UHFFFAOYSA-N
Mol Weight 388.53 g/mol
Molecular Formula C25H24O2S
Exact Mass 388.149701 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID KSkw16kvcRI
Name Methyl 2-(p-phenylphenyl)-2-((2-methylphenyl)thio)-4-pentenoate
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 388.149701185 u
Formula C25H24O2S
InChI InChI=1S/C25H24O2S/c1-4-18-25(24(26)27-3,28-23-13-9-8-10-19(23)2)22-16-14-21(15-17-22)20-11-6-5-7-12-20/h4-17H,1,18H2,2-3H3
InChIKey JAYJKEVPYKKRME-UHFFFAOYSA-N
Molecular Weight 388.525 g/mol
SMILES C(C(CC=C)(SC=1C(=CC=CC1)C)C=1C=CC(=CC1)C=1C=CC=CC1)(=O)OC
Spectrum/Structure Validation Score (Vapor Phase IR) 0.939392