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1-[4-(Methoxycarbonyl)phenyl)-4-phenylbutan-1-ol

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

1-[4-(Methoxycarbonyl)phenyl)-4-phenylbutan-1-ol
SpectraBase Compound ID 5wnCElB3pUr
InChI InChI=1S/C18H20O3/c1-21-18(20)16-12-10-15(11-13-16)17(19)9-5-8-14-6-3-2-4-7-14/h2-4,6-7,10-13,17,19H,5,8-9H2,1H3
InChIKey HUCXMSRLMCXYJZ-UHFFFAOYSA-N
Mol Weight 284.36 g/mol
Molecular Formula C18H20O3
Exact Mass 284.141245 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 4YvWVYgXrZe
Name 1-[4-(Methoxycarbonyl)phenyl)-4-phenylbutan-1-ol
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 284.141244501 u
Formula C18H20O3
InChI InChI=1S/C18H20O3/c1-21-18(20)16-12-10-15(11-13-16)17(19)9-5-8-14-6-3-2-4-7-14/h2-4,6-7,10-13,17,19H,5,8-9H2,1H3
InChIKey HUCXMSRLMCXYJZ-UHFFFAOYSA-N
SMILES C(C1=CC=C(C=C1)C(O)CCCC=1C=CC=CC1)(=O)OC
Spectrum/Structure Validation Score (Vapor Phase IR) 0.935257