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(Q82863019)
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English
Ethanone, 2-(1-methylethoxy)-1,2-diphenyl-
chemical compound
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No label defined
No description defined
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Statements
instance of
type of chemical entity
0 references
subclass of
benzylketone flavonoid
1 reference
based on heuristic
inferred from SMILES
mass
254.130679816
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₁₇H₁₈O₂
1 reference
based on heuristic
inferred from SMILES
canonical SMILES
CC(C)OC(C(=O)c1ccccc1)c1ccccc1
1 reference
based on heuristic
inferred from InChI
Identifiers
InChI
InChI=1S/C17H18O2/c1-13(2)19-17(15-11-7-4-8-12-15)16(18)14-9-5-3-6-10-14/h3-13,17H,1-2H3
0 references
InChIKey
MSAHTMIQULFMRG-UHFFFAOYSA-N
0 references
CAS Registry Number
6652-28-4
1 reference
InChIKey
MSAHTMIQULFMRG-UHFFFAOYSA-N
stated in
CAS Common Chemistry
retrieved
10 April 2021
reference URL
https://commonchemistry.cas.org/detail?cas_rn=6652-28-4
PubChem CID
110912
2 references
stated in
PubChem
retrieved
26 December 2021
inferred from
InChIKey
matched by identifier from
InChIKey
InChIKey
MSAHTMIQULFMRG-UHFFFAOYSA-N
SureChEMBL ID
SCHEMBL25827
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
MSAHTMIQULFMRG-UHFFFAOYSA-N
UniChem compound ID
24363310
1 reference
stated in
UniChem
NMRShiftDB structure ID
20200081
1 reference
matched by identifier from
InChIKey
InChIKey
MSAHTMIQULFMRG-UHFFFAOYSA-N
DSSTox substance ID
DTXSID20884324
1 reference
matched by identifier from
InChIKey
InChIKey
MSAHTMIQULFMRG-UHFFFAOYSA-N
DSSTOX compound identifier
DTXCID401023774
0 references
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