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6-Phenylbenz[B]indeno[2,1-D]thiopyran

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

6-Phenylbenz[B]indeno[2,1-D]thiopyran
SpectraBase Compound ID 2ZBVig4UVAs
InChI InChI=1S/C22H14S/c1-2-8-15(9-3-1)22-21-17-11-5-4-10-16(17)14-19(21)18-12-6-7-13-20(18)23-22/h1-14H
InChIKey OYRGYDLSWAJBCQ-UHFFFAOYSA-N
Mol Weight 310.41 g/mol
Molecular Formula C22H14S
Exact Mass 310.081622 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID LmTjSDzIv8m
Name 6-Phenylbenz[B]indeno[2,1-D]thiopyran
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 310.081621625 u
Formula C22H14S
InChI InChI=1S/C22H14S/c1-2-8-15(9-3-1)22-21-17-11-5-4-10-16(17)14-19(21)18-12-6-7-13-20(18)23-22/h1-14H
InChIKey OYRGYDLSWAJBCQ-UHFFFAOYSA-N
Molecular Weight 310.414 g/mol
SMILES C=12C(=CC3=C2C=CC=C3)C2=CC=CC=C2SC1C=1C=CC=CC1
Spectrum/Structure Validation Score (Vapor Phase IR) 0.928321