Ketcher 06172115522D 1   1.00000     0.00000     0

 15 15  0     0  0            999 V2000
   12.9192   -9.6405    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.9193   -9.6405    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.6103   -8.6894    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.2284   -8.6895    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.4195   -8.1016    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   17.6925   -8.6895    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.8265   -8.1896    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.9604   -8.6895    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.0944   -8.1896    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   18.5585   -8.1896    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   19.4245   -8.6895    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   20.2905   -8.1896    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   21.1565   -8.6896    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   22.0225   -8.1896    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   22.8885   -8.6896    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  1  0     0  0
  3  1  2  0     0  0
  4  2  2  0     0  0
  5  3  1  0     0  0
  5  4  1  0     0  0
  7  6  1  0     0  0
  8  7  1  0     0  0
  9  8  1  0     0  0
  4  9  1  0     0  0
  6 10  1  0     0  0
 10 11  1  0     0  0
 11 12  1  0     0  0
 12 13  1  0     0  0
 13 14  1  0     0  0
 14 15  1  0     0  0
M  END
> <ID>
CHEBI:168892

> <NAME>
2-decylfuran

> <DEFINITION>
A member of the class of furans that is furan in which the hydrogen at position 2 is replaced by a decyl group.

> <STAR>
3

> <SYNONYM>
FEMA 4090; 2-n-decylfuran; 2-decyl-furan

> <IUPAC_NAME>
2-decylfuran

> <FORMULA>
C14H24O

> <MASS>
208.345

> <MONOISOTOPIC_MASS>
208.18272

> <CHARGE>
0

> <SMILES>
CCCCCCCCCCC1=CC=CO1

> <INCHI>
InChI=1S/C14H24O/c1-2-3-4-5-6-7-8-9-11-14-12-10-13-15-14/h10,12-13H,2-9,11H2,1H3

> <INCHIKEY>
PIBKIYYQPWSUDP-UHFFFAOYSA-N

> <CAS_REGISTRY_NUMBER>
83469-85-6

> <CHEMIDPLUS>
83469-85-6

> <NIST_CHEMISTRY_WEBBOOK>
83469-85-6

> <PUBMED_CITATION>
33552300; 33552301

$$$$