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Ethanone, 1-[1,8-dimethoxy-4,6-bis(phenylmethoxy)-2-naphthalenyl]-
SpectraBase Compound ID 2THWC1WoXvS
InChI InChI=1S/C28H26O5/c1-19(29)23-16-25(33-18-21-12-8-5-9-13-21)24-14-22(32-17-20-10-6-4-7-11-20)15-26(30-2)27(24)28(23)31-3/h4-16H,17-18H2,1-3H3
InChIKey WUVXFMDXOKZHEU-UHFFFAOYSA-N
Mol Weight 442.51 g/mol
Molecular Formula C28H26O5
Exact Mass 442.178024 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID DCuntoYeVqQ
Name Ethanone, 1-[1,8-dimethoxy-4,6-bis(phenylmethoxy)-2-naphthalenyl]-
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 442.178023932 u
Formula C28H26O5
InChI InChI=1S/C28H26O5/c1-19(29)23-16-25(33-18-21-12-8-5-9-13-21)24-14-22(32-17-20-10-6-4-7-11-20)15-26(30-2)27(24)28(23)31-3/h4-16H,17-18H2,1-3H3
InChIKey WUVXFMDXOKZHEU-UHFFFAOYSA-N
Molecular Weight 442.511 g/mol
SMILES C12=C(C(C(=O)C)=CC(=C2C=C(C=C1OC)OCC1=CC=CC=C1)OCC1=CC=CC=C1)OC
Spectrum/Structure Validation Score (Vapor Phase IR) 0.848884