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Chemistry, part 2

Content language

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Concept information

... > organooxygen compound > ester > carboxylic ester > fatty acid ester > hexanoate ester > 3-methylbutyl hexanoate
... > organooxygen compound > carbonyl compound > carboxylic ester > fatty acid ester > hexanoate ester > 3-methylbutyl hexanoate
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > organic molecule > organic oxo compound > carbonyl compound > carboxylic ester > fatty acid ester > hexanoate ester > 3-methylbutyl hexanoate
... > chemical entity > molecular entity > polyatomic entity > molecule > organic molecule > organic oxo compound > carbonyl compound > carboxylic ester > fatty acid ester > hexanoate ester > 3-methylbutyl hexanoate
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > lipid > fatty acid derivative > fatty acid ester > hexanoate ester > 3-methylbutyl hexanoate

Preferred term

3-methylbutyl hexanoate  

Type

  • http://www.irandoc.ac.ir/onto/irandoc-meta/Concept

Broader concept

charge

  • 0

formula

  • C11H22O2

has_functional_parent

has_role

inchi

  • InChI=1S/C11H22O2/c1-4-5-6-7-11(12)13-9-8-10(2)3/h10H,4-9H2,1-3H3

inchikey

  • XVSZRAWFCDHCBP-UHFFFAOYSA-N

mass

  • 186.29120

monoisotopicmass

  • 186.16198

smiles

  • CCCCCC(=O)OCCC(C)C

subset

  • 3_STAR

synonym EXACT

  • 3-methylbutyl hexanoate

synonym RELATED

  • 3-methylbutyl caproate
  • isoamyl caproate
  • isoamyl hexanoate
  • isopentyl caproate
  • isopentyl hexanoate

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:87542

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