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3-Octanone, 4-fluoro-2-hydroxy-2-methyl-
SpectraBase Compound ID 6NBhINW3iPr
InChI InChI=1S/C9H17FO2/c1-4-5-6-7(10)8(11)9(2,3)12/h7,12H,4-6H2,1-3H3
InChIKey DWVPUYGKFCBYRZ-UHFFFAOYSA-N
Mol Weight 176.23 g/mol
Molecular Formula C9H17FO2
Exact Mass 176.121258 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JxRXvyFNScb
Name 3-Octanone, 4-fluoro-2-hydroxy-2-methyl-
CAS Registry Number 131864-17-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H17FO2
InChI InChI=1S/C9H17FO2/c1-4-5-6-7(10)8(11)9(2,3)12/h7,12H,4-6H2,1-3H3
InChIKey DWVPUYGKFCBYRZ-UHFFFAOYSA-N
Molecular Weight 176.231 g/mol
SMILES OC(C(=O)C(F)CCCC)(C)C
SPLASH splash10-0002-9300000000-309c9e30ea9258bf55f3
Source of Spectrum J-56-1161-25
Synonyms 4-Fluoro-2-hydroxy-2-methyl-3-octanone 4-Fluoro-2-hydroxy-2-methyloctan-3-one
Wiley ID 1172195