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2-Butanone, 3,3-dimethyl-1-phenyl-
SpectraBase Compound ID GHyhVLlUifr
InChI InChI=1S/C12H16O/c1-12(2,3)11(13)9-10-7-5-4-6-8-10/h4-8H,9H2,1-3H3
InChIKey XPHFHIMIUFOEEN-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 4lYQfIFAahP
Name 2-Butanone, 3,3-dimethyl-1-phenyl-
CAS Registry Number 6721-67-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H16O
InChI InChI=1S/C12H16O/c1-12(2,3)11(13)9-10-7-5-4-6-8-10/h4-8H,9H2,1-3H3
InChIKey XPHFHIMIUFOEEN-UHFFFAOYSA-N
Molecular Weight 176.259 g/mol
SMILES C(C(C)(C)C)(Cc1ccccc1)=O
SPLASH splash10-0a4r-9000000000-0d80d5c8c437f5a5f1b2
Source of Spectrum AJ-57-245-0
Synonyms 3,3-Dimethyl-1-phenyl-2-butanone 3,3-Dimethyl-1-phenyl-butan-2-one
Wiley ID 1172627