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4'-tert-Butyl-acetophenone
SpectraBase Compound ID BbFyUn9WS5w
InChI InChI=1S/C12H16O/c1-9(13)10-5-7-11(8-6-10)12(2,3)4/h5-8H,1-4H3
InChIKey UYFJYGWNYQCHOB-UHFFFAOYSA-N
Mol Weight 176.26 g/mol
Molecular Formula C12H16O
Exact Mass 176.120115 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8HXFiDLfdxo
Name Ethanone,1-[4-(1,1-dimethylethyl)phenyl]-
CAS Registry Number 943-27-1
Classification Chemical
Comments Spectrum verified by crosschecking against external libraries (two reference spectrum with similarity >= 99% found)
Copyright Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 176.120115134 u
Formula C12H16O
InChI InChI=1S/C12H16O/c1-9(13)10-5-7-11(8-6-10)12(2,3)4/h5-8H,1-4H3
InChIKey UYFJYGWNYQCHOB-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 176.259 g/mol
Nominal Mass 176 u
Quality 995
SMILES C(C=1C=CC(C(=O)C)=CC1)(C)(C)C
SPLASH splash10-03di-3900000000-6c69c3b8342a84b38868
Source of Spectrum DigiLab GmbH (C) 2024
Synonyms 1-(4-tert-butylphenyl)ethan-1-one
Technique GC/MS
Wiley ID DD2024_034298