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5-Methoxy-2,2,7-trimethylchroman-4-one
SpectraBase Compound ID JWbJ08mzc78
InChI InChI=1S/C13H16O3/c1-8-5-10(15-4)12-9(14)7-13(2,3)16-11(12)6-8/h5-6H,7H2,1-4H3
InChIKey MXMJUOKCSOHHDB-UHFFFAOYSA-N
Mol Weight 220.27 g/mol
Molecular Formula C13H16O3
Exact Mass 220.109944 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JxRUJtOYnwx
Name 5-Methoxy-2,2,7-trimethylchroman-4-one
Appearance Colorless solid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H16O3
InChI InChI=1S/C13H16O3/c1-8-5-10(15-4)12-9(14)7-13(2,3)16-11(12)6-8/h5-6H,7H2,1-4H3
InChIKey MXMJUOKCSOHHDB-UHFFFAOYSA-N
Ionization Type EI
Literature Reference DOI 10.1002/open.202000343
Molecular Weight 220.268 g/mol
Reported Formula C13H16O3
SMILES c1c(c2c(cc1C)OC(CC2=O)(C)C)OC
SPLASH splash10-052f-9220000000-4fa6687db072626e95c8
Source of Spectrum CHO-10-SM8-17a
Thin-Layer Chromatography Rf = 0.22 (CH/EtOAc, 5:1)
Wiley ID 1865935