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2,2-Ethylenedioxy-4-(6'-methoxynaphthalen-1'-yl)-butane

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

2,2-Ethylenedioxy-4-(6'-methoxynaphthalen-1'-yl)-butane
SpectraBase Compound ID HdiFbfmLfcg
InChI InChI=1S/C17H20O3/c1-17(19-10-11-20-17)9-8-13-4-3-5-14-12-15(18-2)6-7-16(13)14/h3-7,12H,8-11H2,1-2H3
InChIKey ICJPDRMQPGLUBR-UHFFFAOYSA-N
Mol Weight 272.34 g/mol
Molecular Formula C17H20O3
Exact Mass 272.141245 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 6PSBv6mPgXU
Name 2,2-Ethylenedioxy-4-(6'-methoxynaphthalen-1'-yl)-butane
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 272.141244501 u
Formula C17H20O3
InChI InChI=1S/C17H20O3/c1-17(19-10-11-20-17)9-8-13-4-3-5-14-12-15(18-2)6-7-16(13)14/h3-7,12H,8-11H2,1-2H3
InChIKey ICJPDRMQPGLUBR-UHFFFAOYSA-N
SMILES C1(OC)=CC=2C=CC=C(CCC3(C)OCCO3)C2C=C1
Spectrum/Structure Validation Score (Vapor Phase IR) 0.815312