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3-Acetyl-2-allyl-1-ethyl-4-methoxynaphthalene

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

3-Acetyl-2-allyl-1-ethyl-4-methoxynaphthalene
SpectraBase Compound ID 7FrmXpiEIMi
InChI InChI=1S/C18H20O2/c1-5-9-15-13(6-2)14-10-7-8-11-16(14)18(20-4)17(15)12(3)19/h5,7-8,10-11H,1,6,9H2,2-4H3
InChIKey ZVMJGJSBPXPERX-UHFFFAOYSA-N
Mol Weight 268.36 g/mol
Molecular Formula C18H20O2
Exact Mass 268.14633 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID AChmwF7k8H1
Name 3-Acetyl-2-allyl-1-ethyl-4-methoxynaphthalene
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 268.146329882 u
Formula C18H20O2
InChI InChI=1S/C18H20O2/c1-5-9-15-13(6-2)14-10-7-8-11-16(14)18(20-4)17(15)12(3)19/h5,7-8,10-11H,1,6,9H2,2-4H3
InChIKey ZVMJGJSBPXPERX-UHFFFAOYSA-N
SMILES C=1(C(=C(C(=C2C=CC=CC12)OC)C(=O)C)CC=C)CC
Spectrum/Structure Validation Score (Vapor Phase IR) 0.910308