Information from the InChI

There are no matching entries in the database for this IUPAC International Chemical Identifier. The following information was obtained from the identifier.

• Formula: C₆H₁₃NO₂
• Molecular weight: 131.1729
• IUPAC Standard InChI:
  • InChI=1S/C6H13NO2/c1-3-4(2)5(7)6(8)9/h4-5H,3,7H2,1-2H3,(H,8,9)/t4-,5-/m0/s1
• IUPAC Standard InChIKey: AGPKZVBTJJNPAG-WHFBIAKZSA-N
• Connectivity:
• 2-d Mol File from the identifier
• Canonical atom numbers:
  Note: stereochemistry is currently not indicated in the items above.
• Permanent link for this search. Use this link for bookmarking this species for future reference.
• Stereoisomers:
  • allo-L-isoleucine
  • DL-Isoleucine
  • L-Isoleucine

Contents of the identifier

Identifier version: 1

Main section

• Formula: C6H13NO2
• Connectivity: 1-3-4(2)5(7)6(8)9
• Hydrogen: 4-5H,3,7H2,1-2H3,(H,8,9)
• sp³ Stereo: 4-,5-
• Stereo type: 1