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English
1-(2-Thienyl)-ethanone
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
chemical compound
0 references
chemical formula
C₆H₆OS
0 references
canonical SMILES
CC(=O)c1cccs1
1 reference
based on heuristic
inferred from InChI
Identifiers
InChI
InChI=1S/C6H6OS/c1-5(7)6-3-2-4-8-6/h2-4H,1H3
0 references
InChIKey
WYJOVVXUZNRJQY-UHFFFAOYSA-N
1 reference
based on heuristic
inferred from InChI
CAS Registry Number
97511-16-5
0 references
PubChem CID
6920
1 reference
matched by identifier from
InChIKey
InChIKey
WYJOVVXUZNRJQY-UHFFFAOYSA-N
ChEBI ID
179841
mapping relation type
exact match
1 reference
matched by identifier from
International Chemical Identifier
InChI
InChI=1S/C6H6OS/c1-5(7)6-3-2-4-8-6/h2-4H,1H3
SureChEMBL ID
SCHEMBL3798
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
WYJOVVXUZNRJQY-UHFFFAOYSA-N
NMRShiftDB structure ID
10008973
1 reference
matched by identifier from
InChIKey
InChIKey
WYJOVVXUZNRJQY-UHFFFAOYSA-N
Human Metabolome Database ID
HMDB0033133
1 reference
matched by identifier from
InChIKey
InChIKey
WYJOVVXUZNRJQY-UHFFFAOYSA-N
KNApSAcK ID
C00054096
1 reference
matched by identifier from
InChIKey
InChIKey
WYJOVVXUZNRJQY-UHFFFAOYSA-N
UNII
5ASO208T20
1 reference
matched by identifier from
InChIKey
InChIKey
WYJOVVXUZNRJQY-UHFFFAOYSA-N
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