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Benzene, ((3-phenylpropyl)sulfonyl)-

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Benzene, ((3-phenylpropyl)sulfonyl)-
SpectraBase Compound ID DXoztkvf6DH
InChI InChI=1S/C15H16O2S/c16-18(17,15-11-5-2-6-12-15)13-7-10-14-8-3-1-4-9-14/h1-6,8-9,11-12H,7,10,13H2
InChIKey CQWZXJPKOFUKCS-UHFFFAOYSA-N
Mol Weight 260.35 g/mol
Molecular Formula C15H16O2S
Exact Mass 260.087101 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 6C5lrvEDLSg
Name Benzene, ((3-phenylpropyl)sulfonyl)-
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 260.087100927 u
Formula C15H16O2S
InChI InChI=1S/C15H16O2S/c16-18(17,15-11-5-2-6-12-15)13-7-10-14-8-3-1-4-9-14/h1-6,8-9,11-12H,7,10,13H2
InChIKey CQWZXJPKOFUKCS-UHFFFAOYSA-N
Molecular Weight 260.351 g/mol
SMILES C1(=CC=CC=C1)S(=O)(=O)CCCC1=CC=CC=C1
Spectrum/Structure Validation Score (Vapor Phase IR) 0.940325