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3-Bromo-4-methyl-3-penten-2-one
SpectraBase Compound ID 7S2t8p04Tx3
InChI InChI=1S/C6H9BrO/c1-4(2)6(7)5(3)8/h1-3H3
InChIKey LEYKYYVBHICJPQ-UHFFFAOYSA-N
Mol Weight 177.04 g/mol
Molecular Formula C6H9BrO
Exact Mass 175.983678 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AblkF4Gn8lk
Name 3-Bromo-4-methyl-3-penten-2-one
Alternate Name(s) 3-Bromanyl-4-methyl-pent-3-en-2-one 3-Bromo-4-methyl-pent-3-en-2-one 3-Penten-2-one, 3-bromo-4-methyl-
CAS Registry Number 5682-80-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C6H9BrO
InChI InChI=1S/C6H9BrO/c1-4(2)6(7)5(3)8/h1-3H3
InChIKey LEYKYYVBHICJPQ-UHFFFAOYSA-N
Molecular Weight 177.041 g/mol
SMILES C(Br)(C(C)=O)=C(C)C
SPLASH splash10-002f-9300000000-c768fe161c58cd1168d9
Wiley ID 1494440