CHEBI:145717 - 1-(2-hydroxy-1-methylethyl)-2,2-dimethylpropyl 2-methylpropanoate

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ChEBI Name 1-(2-hydroxy-1-methylethyl)-2,2-dimethylpropyl 2-methylpropanoate
ChEBI ID CHEBI:145717
Stars This entity has been manually annotated by a third party.
Submitter Mark Williams
Supplier Information
Download Molfile XML SDF
Formula C12H24O3
Net Charge 0
Average Mass 216.321
Monoisotopic Mass 216.17254
InChI InChI=1S/C12H24O3/c1-8(2)11(14)15-10(9(3)7-13)12(4,5)6/h8-10,13H,7H2,1-6H3
InChIKey YXISVHDWGVMPGJ-UHFFFAOYSA-N
SMILES CC(C)C(=O)OC(C(C)CO)C(C)(C)C
ChEBI Ontology
Outgoing 1-(2-hydroxy-1-methylethyl)-2,2-dimethylpropyl 2-methylpropanoate (CHEBI:145717) is a carboxylic ester (CHEBI:33308)
IUPAC Name
1-hydroxy-2,4,4-trimethylpentan-3-yl 2-methylpropanoate