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1-Naphthalenemethyl mandelate

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

1-Naphthalenemethyl mandelate
SpectraBase Compound ID 3XYcwCaxz8B
InChI InChI=1S/C19H16O3/c20-18(15-8-2-1-3-9-15)19(21)22-13-16-11-6-10-14-7-4-5-12-17(14)16/h1-12,18,20H,13H2
InChIKey UBVNUEFIUWJOGO-UHFFFAOYSA-N
Mol Weight 292.33 g/mol
Molecular Formula C19H16O3
Exact Mass 292.109944 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID FSs6hSrZhpX
Name 1-Naphthalenemethyl mandelate
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 292.109944372 u
Formula C19H16O3
InChI InChI=1S/C19H16O3/c20-18(15-8-2-1-3-9-15)19(21)22-13-16-11-6-10-14-7-4-5-12-17(14)16/h1-12,18,20H,13H2
InChIKey UBVNUEFIUWJOGO-UHFFFAOYSA-N
SMILES C(C(C=1C=CC=CC1)O)(OCC=1C=2C(=CC=CC2)C=CC1)=O
Spectrum/Structure Validation Score (Vapor Phase IR) 0.870862