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1-(3-Methoxyphenyl)-2,2-dimethylpropan-1-one
SpectraBase Compound ID KjyBvjMG6jj
InChI InChI=1S/C12H16O2/c1-12(2,3)11(13)9-6-5-7-10(8-9)14-4/h5-8H,1-4H3
InChIKey IPTMKVLYPISCRA-UHFFFAOYSA-N
Mol Weight 192.26 g/mol
Molecular Formula C12H16O2
Exact Mass 192.11503 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID B8ysgLf3hm5
Name 1-(3-Methoxyphenyl)-2,2-dimethylpropan-1-one
Appearance Colorless oil
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 192.115029753 u
Formula C12H16O2
InChI InChI=1S/C12H16O2/c1-12(2,3)11(13)9-6-5-7-10(8-9)14-4/h5-8H,1-4H3
InChIKey IPTMKVLYPISCRA-UHFFFAOYSA-N
Instrument Name Shimadzu QP 1000
Ionization Type EI
Literature Reference DOI 10.1002/chem.202004840
Molecular Weight 192.258 g/mol
Quality 156
SMILES C=1(C=CC=C(C(=O)C(C)(C)C)C1)OC
SPLASH splash10-000i-2900000000-50f292a60527196e95ca
Source of Spectrum QE-27-SM33-2i (DOI: 10.1002/chem.202004840)
Thin-Layer Chromatography 0.35 (petroleum ether/EtOAc, 95:5)
Wiley ID 1902307