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2-(2-n-Heptylphenyl)pyridine

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

2-(2-n-Heptylphenyl)pyridine
SpectraBase Compound ID 39iKEtZP6Hd
InChI InChI=1S/C18H23N/c1-2-3-4-5-6-11-16-12-7-8-13-17(16)18-14-9-10-15-19-18/h7-10,12-15H,2-6,11H2,1H3
InChIKey YDZDLLFDOJEEAY-UHFFFAOYSA-N
Mol Weight 253.39 g/mol
Molecular Formula C18H23N
Exact Mass 253.18305 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 76lW1QlxCUW
Name 2-(2-N-Heptylphenyl)pyridine
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 253.183049745 u
Formula C18H23N
InChI InChI=1S/C18H23N/c1-2-3-4-5-6-11-16-12-7-8-13-17(16)18-14-9-10-15-19-18/h7-10,12-15H,2-6,11H2,1H3
InChIKey YDZDLLFDOJEEAY-UHFFFAOYSA-N
Molecular Weight 253.389 g/mol
SMILES C=1C(=C(CCCCCCC)C=CC1)C=1C=CC=CN1
Spectrum/Structure Validation Score (Vapor Phase IR) 0.947304