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Chemistry, part 2

Content language

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Concept information

organooxygen compound > ester > carboxylic ester > fatty acid ester > 2-methylbutyl octanoate
organooxygen compound > carbonyl compound > carboxylic ester > fatty acid ester > 2-methylbutyl octanoate
... > 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 > 2-methylbutyl octanoate
... > chemical entity > molecular entity > polyatomic entity > molecule > organic molecule > organic oxo compound > carbonyl compound > carboxylic ester > fatty acid ester > 2-methylbutyl octanoate
... > 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 > 2-methylbutyl octanoate

Preferred term

2-methylbutyl octanoate  

Type

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

Broader concept

charge

  • 0

formula

  • C13H26O2

inchi

  • InChI=1S/C13H26O2/c1-4-6-7-8-9-10-13(14)15-11-12(3)5-2/h12H,4-11H2,1-3H3

inchikey

  • XZLBJDGPIWDVIJ-UHFFFAOYSA-N

mass

  • 214.349

monoisotopicmass

  • 214.19328

smiles

  • O(CC(CC)C)C(=O)CCCCCCC

subset

  • 2_STAR

synonym EXACT

  • 2-methylbutyl octanoate

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:180113

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