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1-Butanone, 3-methyl-2-methylene-1-phenyl-
SpectraBase Compound ID FpgmOCtrNBl
InChI InChI=1S/C12H14O/c1-9(2)10(3)12(13)11-7-5-4-6-8-11/h4-9H,3H2,1-2H3
InChIKey JGGXQMKYHHNJAF-UHFFFAOYSA-N
Mol Weight 174.24 g/mol
Molecular Formula C12H14O
Exact Mass 174.104465 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GTst4K1neio
Name 1-Butanone, 3-methyl-2-methylene-1-phenyl-
CAS Registry Number 80325-63-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H14O
InChI InChI=1S/C12H14O/c1-9(2)10(3)12(13)11-7-5-4-6-8-11/h4-9H,3H2,1-2H3
InChIKey JGGXQMKYHHNJAF-UHFFFAOYSA-N
Molecular Weight 174.243 g/mol
SMILES C(C(=O)c1ccccc1)(=C)C(C)C
SPLASH splash10-0a4i-0900000000-4f17cd9b8cb01bd217cf
Source of Spectrum AJ-61-130-7
Synonyms 2-Isopropyl-1-phenyl-2-propen-1-one 3-Methyl-2-methylene-1-phenyl-1-butanone 3-Methyl-2-methylidene-1-phenylbutan-1-one 3-Methyl-2-methylene-1-phenyl-butan-1-one 3-Methyl-2-methylidene-1-phenyl-butan-1-one
Wiley ID 1171059