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(Q82553461)
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English
1-(2-Fluorophenyl)-3,3-dimethylbutan-1-one
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
chemical compound
0 references
mass
194.11069332
dalton
1 reference
based on heuristic
inferred from InChI
chemical formula
C₁₂H₁₅FO
0 references
canonical SMILES
CC(C)(C)CC(=O)C1=CC=CC=C1F
0 references
Identifiers
InChI
InChI=1S/C12H15FO/c1-12(2,3)8-11(14)9-6-4-5-7-10(9)13/h4-7H,8H2,1-3H3
0 references
InChIKey
GSAGLACKEKPELM-UHFFFAOYSA-N
0 references
CAS Registry Number
898764-70-0
1 reference
InChIKey
GSAGLACKEKPELM-UHFFFAOYSA-N
stated in
CAS Common Chemistry
retrieved
10 April 2021
reference URL
https://commonchemistry.cas.org/detail?cas_rn=898764-70-0
PubChem CID
24724001
1 reference
matched by identifier from
InChIKey
InChIKey
GSAGLACKEKPELM-UHFFFAOYSA-N
UniChem compound ID
23259722
1 reference
stated in
UniChem
DSSTox substance ID
DTXSID60642400
1 reference
matched by identifier from
InChIKey
InChIKey
GSAGLACKEKPELM-UHFFFAOYSA-N
DSSTOX compound identifier
DTXCID70593151
0 references
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