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3-[2,5-Bis(methoxymethoxy)phenyl]-4-isopropylidene-1-methylcyclohexene
SpectraBase Compound ID A5sHXZIqY7g
InChI InChI=1S/C20H28O4/c1-14(2)17-8-6-15(3)10-18(17)19-11-16(23-12-21-4)7-9-20(19)24-13-22-5/h7,9-11,18H,6,8,12-13H2,1-5H3
InChIKey XVGOJNDOMFPALR-UHFFFAOYSA-N
Mol Weight 332.44 g/mol
Molecular Formula C20H28O4
Exact Mass 332.198759 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 64E4DiTUw5E
Name 3-[2,5-bis(Methoxymethoxy)phenyl]-4-isopropylidene-1-methylcyclohexene
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 332.198759378 u
Formula C20H28O4
InChI InChI=1S/C20H28O4/c1-14(2)17-8-6-15(3)10-18(17)19-11-16(23-12-21-4)7-9-20(19)24-13-22-5/h7,9-11,18H,6,8,12-13H2,1-5H3
InChIKey XVGOJNDOMFPALR-UHFFFAOYSA-N
Molecular Weight 332.440 g/mol
SMILES C1(C(=C(C)C)CCC(=C1)C)C=1C(=CC=C(C1)OCOC)OCOC
Spectrum/Structure Validation Score (Vapor Phase IR) 0.865029