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1-Pentanone, 4,5-dimethoxy-2,2-dimethyl-1-phenyl-

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

1-Pentanone, 4,5-dimethoxy-2,2-dimethyl-1-phenyl-
SpectraBase Compound ID LtXSJ5H9DLK
InChI InChI=1S/C15H22O3/c1-15(2,10-13(18-4)11-17-3)14(16)12-8-6-5-7-9-12/h5-9,13H,10-11H2,1-4H3
InChIKey OVEGIINBFNQYJB-UHFFFAOYSA-N
Mol Weight 250.34 g/mol
Molecular Formula C15H22O3
Exact Mass 250.156895 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID ID0Xm1sWcXL
Name 1-Pentanone, 4,5-dimethoxy-2,2-dimethyl-1-phenyl-
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 250.156894565 u
Formula C15H22O3
InChI InChI=1S/C15H22O3/c1-15(2,10-13(18-4)11-17-3)14(16)12-8-6-5-7-9-12/h5-9,13H,10-11H2,1-4H3
InChIKey OVEGIINBFNQYJB-UHFFFAOYSA-N
Molecular Weight 250.338 g/mol
SMILES C(C(=O)C=1C=CC=CC1)(CC(OC)COC)(C)C
Spectrum/Structure Validation Score (Vapor Phase IR) 0.978756