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Phenyl-1-pyrenylmethylcarbenium_ion

View entire compound with spectra: 1 NMR, and 1 FTIR

Phenyl-1-pyrenylmethylcarbenium_ion
SpectraBase Compound ID CdOsQHUJw03
InChI InChI=1S/C23H16/c1-2-5-16(6-3-1)15-20-12-11-19-10-9-17-7-4-8-18-13-14-21(20)23(19)22(17)18/h1-14H,15H2
InChIKey KBUVRXNOTZNAPI-UHFFFAOYSA-N
Mol Weight 292.38 g/mol
Molecular Formula C23H16
Exact Mass 292.125201 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID K5Ry4MkUI8B
Name Phenyl-1-pyrenylmethylcarbenium_ion
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 292.125200515 u
Formula C23H16
InChI InChI=1S/C23H16/c1-2-5-16(6-3-1)15-20-12-11-19-10-9-17-7-4-8-18-13-14-21(20)23(19)22(17)18/h1-14H,15H2
InChIKey KBUVRXNOTZNAPI-UHFFFAOYSA-N
Molecular Weight 292.381 g/mol
SMILES C=12C(CC=3C=CC=CC3)=CC=C3C1C1=C(C=C3)C=CC=C1C=C2
Spectrum/Structure Validation Score (Vapor Phase IR) 0.824784