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4-(p-Bromophenyl)-2,2-diphenyl-3,4-dihydro-2H-thiopyran

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

4-(p-Bromophenyl)-2,2-diphenyl-3,4-dihydro-2H-thiopyran
SpectraBase Compound ID GVCIFjLwHT1
InChI InChI=1S/C23H19BrS/c24-22-13-11-18(12-14-22)19-15-16-25-23(17-19,20-7-3-1-4-8-20)21-9-5-2-6-10-21/h1-16,19H,17H2
InChIKey QATHEXFXRIDHSA-UHFFFAOYSA-N
Mol Weight 407.37 g/mol
Molecular Formula C23H19BrS
Exact Mass 406.039085 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 1mmkOTxpBzO
Name 4-(p-Bromophenyl)-2,2-diphenyl-3,4-dihydro-2H-thiopyran
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 406.039084786 u
Formula C23H19BrS
InChI InChI=1S/C23H19BrS/c24-22-13-11-18(12-14-22)19-15-16-25-23(17-19,20-7-3-1-4-8-20)21-9-5-2-6-10-21/h1-16,19H,17H2
InChIKey QATHEXFXRIDHSA-UHFFFAOYSA-N
Molecular Weight 407.369 g/mol
SMILES C1(CC(C=2C=CC(=CC2)Br)C=CS1)(C1=CC=CC=C1)C1=CC=CC=C1
Spectrum/Structure Validation Score (Vapor Phase IR) 0.944781