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3-Heptanone, 5-(3,5-dimethoxyphenyl)-2,2,6,6-tetramethyl-

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

3-Heptanone, 5-(3,5-dimethoxyphenyl)-2,2,6,6-tetramethyl-
SpectraBase Compound ID 1zMpn09c5aT
InChI InChI=1S/C19H30O3/c1-18(2,3)16(12-17(20)19(4,5)6)13-9-14(21-7)11-15(10-13)22-8/h9-11,16H,12H2,1-8H3
InChIKey TVRHKOGXHIOVGZ-UHFFFAOYSA-N
Mol Weight 306.45 g/mol
Molecular Formula C19H30O3
Exact Mass 306.219495 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 8Se1mLdVLpN
Name 3-Heptanone, 5-(3,5-dimethoxyphenyl)-2,2,6,6-tetramethyl-
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 306.219494823 u
Formula C19H30O3
InChI InChI=1S/C19H30O3/c1-18(2,3)16(12-17(20)19(4,5)6)13-9-14(21-7)11-15(10-13)22-8/h9-11,16H,12H2,1-8H3
InChIKey TVRHKOGXHIOVGZ-UHFFFAOYSA-N
SMILES C=1(C(CC(C(C)(C)C)=O)C(C)(C)C)C=C(OC)C=C(C1)OC
Spectrum/Structure Validation Score (Vapor Phase IR) 0.974458