CHEBI:198834 - 2-sec-Butyl-5-isobutyl-3-methoxypyrazine

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
This entity has been annotated by a third party. If you would like more information added to this entry, please contact ChEBI via email or GitHub.
ChEBI Name 2-sec-Butyl-5-isobutyl-3-methoxypyrazine
ChEBI ID CHEBI:198834
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C13H22N2O
Net Charge 0
Average Mass 222.332
Monoisotopic Mass 222.17321
InChI InChI=1S/C13H22N2O/c1-6-10(4)12-13(16-5)15-11(8-14-12)7-9(2)3/h8-10H,6-7H2,1-5H3/t10-/m0/s1
InChIKey IDHPEMYHBNUQMC-JTQLQIEISA-N
SMILES O(C1=NC(=CN=C1[C@H](CC)C)CC(C)C)C
Metabolite of Species Details
Sulfitobacter pontiacus (NCBI:txid60137) See: DOI
ChEBI Ontology
Outgoing 2-sec-Butyl-5-isobutyl-3-methoxypyrazine (CHEBI:198834) is a aromatic ether (CHEBI:35618)
2-sec-Butyl-5-isobutyl-3-methoxypyrazine (CHEBI:198834) is a pyrazines (CHEBI:38314)
IUPAC Name
2-butan-2-yl-3-methoxy-5-(2-methylpropyl)pyrazine
Manual Xref Database
9754220 ChemSpider
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