Molecule

6-pentylpyran-2-one

Chemical Information

Molecular Image

InChI	InChI=1S/C10H14O2/c1-2-3-4-6-9-7-5-8-10(11)12-9/h5,7-8H,2-4,6H2,1H3
SMILES	CCCCCC1=CC=CC(=O)O1
InChI Key	MAUFTTLGOUBZNA-UHFFFAOYSA-N
Exact Mass	166.220 g/mol

14 Related Dataset(s) ⌄

6-PENTYL-2-PYRONE; EI-B; MS

6-Pentyl-2H-pyran-2-one; LC-ESI-QFT; MS2; CE: 15; R=17500; [M+H]+

6-Pentyl-2H-pyran-2-one; LC-ESI-QFT; MS2; CE: 30; R=17500; [M+H]+

6-Pentyl-2H-pyran-2-one; LC-ESI-QFT; MS2; CE: 45; R=17500; [M+H]+

6-Pentyl-2H-pyran-2-one; LC-ESI-QFT; MS2; CE: 60; R=17500; [M+H]+

6-Pentyl-2H-pyran-2-one; LC-ESI-QFT; MS2; CE: 75; R=17500; [M+H]+

6-Pentyl-2H-pyran-2-one; LC-ESI-QFT; MS2; CE: 90; R=17500; [M+H]+

6-PENTYL-ALPHA-PYRONE; EI-B; MS

MC047_9[1]

MC047_9[2]

MC047_9[3]

MC047_9[5]

MC047_9[6]

MC047_9[7]

Metadata Information

Field	Value
NFDI4Chem Molecule ID	nfdi4chem-mol9435
Source
Alternate Name

Field	Value
No additional information available for this Dataset.

Data-Source Molecule ID	Data-Source
CHEBI:66729	chebi
CHEMBL503899	chembl
968257	surechembl
33960	pubchem
8JTW8HL4PJ	fdasrs
HMDB0031085	hmdb
DTXSID0047589	comptox
FDB003090	foodb
Molport-001-766-489	molport
The data in this table is sourced from UniChem at EBI.