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Chemistry, part 1

Content language

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Concept information

organooxygen compound > ester > carboxylic ester > benzoate ester > methyl 4-(3-hydroxy-3-methylbut-1-ynyl)benzoate
organooxygen compound > carbonyl compound > carboxylic ester > benzoate ester > methyl 4-(3-hydroxy-3-methylbut-1-ynyl)benzoate

Preferred term

methyl 4-(3-hydroxy-3-methylbut-1-ynyl)benzoate  

Type

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

Broader concept

charge

  • 0

formula

  • C13H14O3

inchi

  • InChI=1S/C13H14O3/c1-13(2,15)9-8-10-4-6-11(7-5-10)12(14)16-3/h4-7,15H,1-3H3

inchikey

  • HPQVSXSPVIQMCE-UHFFFAOYSA-N

mass

  • 218.252

monoisotopicmass

  • 218.09429

smiles

  • OC(C)(C)C#CC1=CC=C(C=C1)C(OC)=O

subset

  • 2_STAR

synonym EXACT

  • methyl 4-(3-hydroxy-3-methylbut-1-ynyl)benzoate

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:194959

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