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Phenol, 4-[3-(1-perhydroazocinyl)butyl]-

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

Phenol, 4-[3-(1-perhydroazocinyl)butyl]-
SpectraBase Compound ID 8jOEgCcOhT3
InChI InChI=1S/C17H27NO/c1-15(18-13-5-3-2-4-6-14-18)7-8-16-9-11-17(19)12-10-16/h9-12,15,19H,2-8,13-14H2,1H3
InChIKey DQGHXBYRUIRJGZ-UHFFFAOYSA-N
Mol Weight 261.41 g/mol
Molecular Formula C17H27NO
Exact Mass 261.209264 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID E52tBv3zDOH
Name Phenol, 4-[3-(1-perhydroazocinyl)butyl]-
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 261.209264492 u
Formula C17H27NO
InChI InChI=1S/C17H27NO/c1-15(18-13-5-3-2-4-6-14-18)7-8-16-9-11-17(19)12-10-16/h9-12,15,19H,2-8,13-14H2,1H3
InChIKey DQGHXBYRUIRJGZ-UHFFFAOYSA-N
Molecular Weight 261.409 g/mol
SMILES C1CN(CCCCC1)C(CCC=1C=CC(=CC1)O)C
Spectrum/Structure Validation Score (Vapor Phase IR) 0.961545