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5-Hepten-2-one, 1,1,1-trifluoro-6-methyl-
SpectraBase Compound ID IsEQrmiBlJx
InChI InChI=1S/C8H11F3O/c1-6(2)4-3-5-7(12)8(9,10)11/h1,3-5H2,2H3
InChIKey VEBWAFPSWDPMQN-UHFFFAOYSA-N
Mol Weight 180.17 g/mol
Molecular Formula C8H11F3O
Exact Mass 180.076199 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EC6SJF8qenC
Name 5-Hepten-2-one, 1,1,1-trifluoro-6-methyl-
CAS Registry Number 60244-35-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C8H11F3O
InChI InChI=1S/C8H11F3O/c1-6(2)4-3-5-7(12)8(9,10)11/h1,3-5H2,2H3
InChIKey VEBWAFPSWDPMQN-UHFFFAOYSA-N
Molecular Weight 180.170 g/mol
SMILES C(C(=O)CCCC(=C)C)(F)(F)F
SPLASH splash10-00kf-9000000000-df1867e321482e3df9ba
Source of Spectrum F-34-2182-0
Synonyms 1,1,1-trifluoro-6-methyl-6-hepten-2-one 1,1,1-Trifluoro-6-methylhept-6-en-2-one
Wiley ID 1175867