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5-(Bromomethyl)-3-methyl-.gamma.-butyrolactone
SpectraBase Compound ID AQ80ysiO3Kw
InChI InChI=1S/C6H9BrO2/c1-4-2-5(3-7)9-6(4)8/h4-5H,2-3H2,1H3
InChIKey COGOCUIUPCRFDG-UHFFFAOYSA-N
Mol Weight 193.04 g/mol
Molecular Formula C6H9BrO2
Exact Mass 191.978593 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6PrUHyhgqbe
Name 5-(Bromomethyl)-3-methyl-.gamma.-butyrolactone
Comments Less than 3 mono-isotopic peaks
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Formula C6H9BrO2
InChI InChI=1S/C6H9BrO2/c1-4-2-5(3-7)9-6(4)8/h4-5H,2-3H2,1H3
InChIKey COGOCUIUPCRFDG-UHFFFAOYSA-N
Molecular Weight 193.040 g/mol
SMILES C1(OC(CBr)CC1C)=O
SPLASH splash10-0007-0900000000-85cb29aa11c47f04e801
Source of Spectrum Y-48-697-2b
Synonyms 5-Bromomethyl-3-methyl-dihydro-furan-2-one 5-(bromomethyl)-3-methyl-2-oxolanone 5-(bromomethyl)-3-methyloxolan-2-one 5-(bromomethyl)-3-methyl-oxolan-2-one
Wiley ID 1667799