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1-(Phenylmethyl)-3-(phenylsulfonyl)pyrrolidine

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

1-(Phenylmethyl)-3-(phenylsulfonyl)pyrrolidine
SpectraBase Compound ID 6djlfmYGZea
InChI InChI=1S/C17H19NO2S/c19-21(20,16-9-5-2-6-10-16)17-11-12-18(14-17)13-15-7-3-1-4-8-15/h1-10,17H,11-14H2
InChIKey OTTOUOKAVIJSMY-UHFFFAOYSA-N
Mol Weight 301.4 g/mol
Molecular Formula C17H19NO2S
Exact Mass 301.11365 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID Gds3TX9SkUk
Name 1-(Phenylmethyl)-3-(phenylsulfonyl)pyrrolidine
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 301.113650028 u
Formula C17H19NO2S
InChI InChI=1S/C17H19NO2S/c19-21(20,16-9-5-2-6-10-16)17-11-12-18(14-17)13-15-7-3-1-4-8-15/h1-10,17H,11-14H2
InChIKey OTTOUOKAVIJSMY-UHFFFAOYSA-N
Molecular Weight 301.404 g/mol
SMILES C1(S(=O)(=O)C=2C=CC=CC2)CN(CC=2C=CC=CC2)CC1
Spectrum/Structure Validation Score (Vapor Phase IR) 0.813372