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English
5-Butyl-1,3-oxazole
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
chemical compound
0 references
mass
125.084063972
dalton
1 reference
based on heuristic
inferred from InChI
chemical formula
C₇H₁₁NO
0 references
canonical SMILES
CCCCC1=CN=CO1
0 references
Identifiers
InChI
InChI=1S/C7H11NO/c1-2-3-4-7-5-8-6-9-7/h5-6H,2-4H2,1H3
0 references
InChIKey
HVDQDMRCRULNJN-UHFFFAOYSA-N
0 references
CAS Registry Number
77311-06-9
1 reference
stated in
CAS Common Chemistry
retrieved
6 April 2021
reference URL
https://commonchemistry.cas.org/detail?cas_rn=77311-06-9
InChIKey
HVDQDMRCRULNJN-UHFFFAOYSA-N
PubChem CID
18000835
2 references
stated in
PubChem
retrieved
26 December 2021
inferred from
InChIKey
matched by identifier from
InChIKey
InChIKey
HVDQDMRCRULNJN-UHFFFAOYSA-N
ChEBI ID
193629
mapping relation type
exact match
1 reference
matched by identifier from
International Chemical Identifier
InChI
InChI=1S/C7H11NO/c1-2-3-4-7-5-8-6-9-7/h5-6H,2-4H2,1H3
UniChem compound ID
32019054
1 reference
stated in
UniChem
DSSTox substance ID
DTXSID10592385
1 reference
matched by identifier from
InChIKey
InChIKey
HVDQDMRCRULNJN-UHFFFAOYSA-N
DSSTOX compound identifier
DTXCID00543149
0 references
Human Metabolome Database ID
HMDB0038289
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
HVDQDMRCRULNJN-UHFFFAOYSA-N
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