input word = C00053574

Metabolite InformationStructural formula
Name FEMA 2788
Nonyl acetate
Formula C11H22O2
Mw 186.16197995
CAS RN 143-13-5
C_ID C00053574
InChIKey GJQIMXVRFNLMTB-UHFFFAOYSA-N
InChICode InChI=1S/C11H22O2/c1-3-4-5-6-7-8-9-10-13-11(2)12/h3-10H2,1-2H3
SMILES CCCCCCCCCOC(C)=O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeRutaceaeCitrus sinensis Ref.
PlantaeRutaceaeRuta graveolens Ref.
PlantaeSolanaceaeMandragora autumnalis Ref.
PlantaeSolanaceaeSolanum muricaturm Ref.
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OrganismSolanum muricaturm
ReferenceAldrich Library of FT-IR Spectra, 1st edn.,1985, 1, 111B (ir)