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5-Methylenehexadecoxymethylbenzene

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

5-Methylenehexadecoxymethylbenzene
SpectraBase Compound ID LxtlgXJj6cs
InChI InChI=1S/C24H40O/c1-3-4-5-6-7-8-9-10-12-17-23(2)18-15-16-21-25-22-24-19-13-11-14-20-24/h11,13-14,19-20H,2-10,12,15-18,21-22H2,1H3
InChIKey BVWMVBZIAOVHTH-UHFFFAOYSA-N
Mol Weight 344.6 g/mol
Molecular Formula C24H40O
Exact Mass 344.307916 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 4QI4PoowPYp
Name 5-Methylenehexadecoxymethylbenzene
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 344.307915907 u
Formula C24H40O
InChI InChI=1S/C24H40O/c1-3-4-5-6-7-8-9-10-12-17-23(2)18-15-16-21-25-22-24-19-13-11-14-20-24/h11,13-14,19-20H,2-10,12,15-18,21-22H2,1H3
InChIKey BVWMVBZIAOVHTH-UHFFFAOYSA-N
Molecular Weight 344.583 g/mol
SMILES C(=C)(CCCCOCC=1C=CC=CC1)CCCCCCCCCCC
Spectrum/Structure Validation Score (Vapor Phase IR) 0.905158