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3-Tert-butyl-3,6-dimethoxy-6-methylcyclohexa-1,4-diene

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3-Tert-butyl-3,6-dimethoxy-6-methylcyclohexa-1,4-diene
SpectraBase Compound ID DZPb9RR2BjL
InChI InChI=1S/C13H22O2/c1-11(2,3)13(15-6)9-7-12(4,14-5)8-10-13/h7-10H,1-6H3
InChIKey HTWSFLBABWOKLE-UHFFFAOYSA-N
Mol Weight 210.32 g/mol
Molecular Formula C13H22O2
Exact Mass 210.16198 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 772yD1fxpIb
Name 3-Tert-butyl-3,6-dimethoxy-6-methylcyclohexa-1,4-diene
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 210.161979946 u
Formula C13H22O2
InChI InChI=1S/C13H22O2/c1-11(2,3)13(15-6)9-7-12(4,14-5)8-10-13/h7-10H,1-6H3
InChIKey HTWSFLBABWOKLE-UHFFFAOYSA-N
Molecular Weight 210.317 g/mol
SMILES C1(C=CC(C=C1)(OC)C)(C(C)(C)C)OC
Spectrum/Structure Validation Score (Vapor Phase IR) 0.894062