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2-Hydroxy-2-methyl-3-oxobutyl 2-methylprop-2-enoate
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
biogenic acyclic ester
0 references
mass
186.089208928
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₉H₁₄O₄
0 references
canonical SMILES
O=C(OCC(O)(C(=O)C)C)C(=C)C
0 references
found in taxon
Chamaemelum fuscatum
1 reference
stated in
Sesquiterpene lactones and aliphatic ester from Chamaemelum fuscatum
Identifiers
InChI
InChI=1S/C9H14O4/c1-6(2)8(11)13-5-9(4,12)7(3)10/h12H,1,5H2,2-4H3
0 references
InChIKey
NFNXUHHOCPTCOZ-UHFFFAOYSA-N
0 references
CAS Registry Number
88142-98-7
0 references
PubChem CID
71410541
2 references
stated in
PubChem
retrieved
26 December 2021
inferred from
InChIKey
matched by identifier from
InChIKey
InChIKey
NFNXUHHOCPTCOZ-UHFFFAOYSA-N
UniChem compound ID
59357565
1 reference
stated in
UniChem
DSSTox substance ID
DTXSID30830216
1 reference
matched by identifier from
InChIKey
InChIKey
NFNXUHHOCPTCOZ-UHFFFAOYSA-N
DSSTOX compound identifier
DTXCID20780958
0 references
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