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1-(2,4-dihydroxy-5-isopropylphenyl)ethan-1-one
SpectraBase Compound ID 56uY6z7wKr6
InChI InChI=1S/C11H14O3/c1-6(2)8-4-9(7(3)12)11(14)5-10(8)13/h4-6,13-14H,1-3H3
InChIKey YFIAXNACMLJXRX-UHFFFAOYSA-N
Mol Weight 194.23 g/mol
Molecular Formula C11H14O3
Exact Mass 194.094294 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GkSYNr4aaJe
Name 1-(2,4-dihydroxy-5-isopropylphenyl)ethan-1-one
Appearance Colorless solid
Carrier Gas Helium
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 194.094294308 u
Formula C11H14O3
GC Oven Program Oven temp 300oC
InChI InChI=1S/C11H14O3/c1-6(2)8-4-9(7(3)12)11(14)5-10(8)13/h4-6,13-14H,1-3H3
InChIKey YFIAXNACMLJXRX-UHFFFAOYSA-N
Instrument Name Agilent 7890A-5975C
Ionization Type EI
Literature Reference DOI 10.1002/anie.201703270
Molecular Weight 194.230 g/mol
Quality 888
SMILES OC1=CC(=C(C=C1C(C)C)C(C)=O)O
SPLASH splash10-004i-4900000000-f8c966f9dbbee97bf42a
Source of Spectrum ACI-56-SM31-2f (DOI: 10.1002/anie.201703270)
Thin-Layer Chromatography 0.6 (CH2Cl2/EtOAc, 90:10)
Wiley ID 1896057