Nonan-2-one

2-nonanone
beta-Nonanone
heptyl methyl ketone
Methyl heptyl ketone
Methyl n-heptyl ketone
n-C7H15COCH3
NONANONE-2

Property	Value
Elemental charge chemrof:elemental_charge	0
InChI2D key string chemrof:inchi2d_key_string	VKCYHJWLYTUGCC-UHFFFAOYSA-N
InChI2D string chemrof:inchi2d_string	InChI=1S/C9H18O/c1-3-4-5-6-7-8-9(2)10/h3-8H2,1-2H3
IUPAC name chemrof:IUPAC_name	Nonan-2-one
Molecular formula chemrof:molecular_formula	C9H18O
Molecular mass chemrof:molecular_mass	142.242
Monoisotopic mass chemrof:monoisotopic_mass	142.135765, 142.13577
SMILES string chemrof:smiles_string	CCCCCCCC(C)=O

Where else this substance is described. Collected while the pipeline resolved it — from ChEBI's cross-references, from PubChem's identifier list, and from the CAS number — so a link here is a record the merge actually read, not a search it suggests.

Resource	URL	Recorded by
agr	agr:IND500714276	enrich_references.chebi_xrefs
CAS Common Chemistry	https://commonchemistry.cas.org/detail?cas_rn=821-55-6	enrich_references.chebi_xrefs
ChEBI	https://www.ebi.ac.uk/chebi/searchId.do?chebiId=CHEBI:77927	enrich_references.chebi_id_link
chem.echa.europa.eu	https://chem.echa.europa.eu/100.011.345	enrich_references.pubchem_identifier_url
comptox.epa.gov	https://comptox.epa.gov/dashboard/DTXSID2022125	enrich_references.pubchem_identifier_url
dtp.cancer.gov	https://dtp.cancer.gov/dtpstandard/servlet/dwindex?searchtype=NSC&outputformat=html&searchlist=14760	enrich_references.pubchem_identifier_url
ebi.ac.uk	https://www.ebi.ac.uk/chembl/explore/compound/CHEMBL2228473	enrich_references.pubchem_identifier_url
femaflavor.org	https://www.femaflavor.org/flavor-library/2-nonanone	enrich_references.pubchem_identifier_url
gsrs.ncats.nih.gov	https://gsrs.ncats.nih.gov/ginas/app/beta/substances/ZE5K73YN2Z	enrich_references.pubchem_identifier_url
HMDB	https://hmdb.ca/metabolites/HMDB0031266	enrich_references.chebi_xrefs
jglobal.jst.go.jp	http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J7.123D	enrich_references.pubchem_identifier_url
lipidmaps.org	https://lipidmaps.org/databases/lmsd/LMFA12000052	enrich_references.pubchem_identifier_url
metabolomicsworkbench.org	https://www.metabolomicsworkbench.org/data/StructureData.php?RegNo=5458	enrich_references.pubchem_identifier_url
PubChem	https://pubchem.ncbi.nlm.nih.gov/compound/13187	enrich_references.pubchem_compound
PubChem	https://pubchem.ncbi.nlm.nih.gov/erg/#1224	enrich_references.pubchem_identifier_url
PubMed	https://pubmed.ncbi.nlm.nih.gov/23580469	enrich_references.chebi_xrefs
PubMed	https://pubmed.ncbi.nlm.nih.gov/24045155	enrich_references.chebi_xrefs
PubMed	https://pubmed.ncbi.nlm.nih.gov/24262538	enrich_references.chebi_xrefs
PubMed	https://pubmed.ncbi.nlm.nih.gov/24441709	enrich_references.chebi_xrefs
PubMed	https://pubmed.ncbi.nlm.nih.gov/24621664	enrich_references.chebi_xrefs
reaxys	reaxys:1743645	enrich_references.chebi_xrefs
Wikidata	https://www.wikidata.org/wiki/Q15726063	enrich_references.pubchem_identifier_url

Flow	Context	Source	Unit	CFs
9d7cc8ec-13ce-49ac-84e1-0d16dc03522e	Environmental → Air → Aircraft cruise height	EF 3.1	kg	2
426c1f23-b5a5-484f-8fb0-8fa1969b83a2	Environmental → Air → Ground level → Urban (>1000 people/square mile)	EF 3.1	kg	2
3b1cd1f1-7a7e-43a7-a633-d039fa940850	Environmental → Air → Indoor	EF 3.1	kg	2
04f8f5b8-6ae4-4135-a791-b523bb987e61	Environmental → Air → Long-term	EF 3.1	kg	0
5130392a-978a-4ce7-ae7c-c34a140cb513	Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile)	EF 3.1	kg	2
78fe4038-8a70-4ea4-87a4-1e4d07fab335	Environmental → Air → Unknown	EF 3.1	kg	2
217090d8-8979-4b78-acde-04092a29e576	Environmental → Ground → Agricultural	EF 3.1	kg	2
3d1b94e1-4013-4d10-a871-e38dada65df3	Environmental → Ground → Non-agricultural	EF 3.1	kg	2
2f2a206b-759d-4ad5-b444-6cff46c8506d	Environmental → Ground → Unknown	EF 3.1	kg	2
b91cdb24-1891-47b0-83a5-b5e9b8d7b719	Environmental → Water → Long-term	EF 3.1	kg	0
d319c181-d495-4514-81a0-a9d63421ca18	Environmental → Water → Ocean	EF 3.1	kg	2
9cace835-89b2-4261-a84a-5e1ea539c66b	Environmental → Water → Surface water	EF 3.1	kg	2
a82dadd7-d0ef-43da-8596-d7e007487efd	Environmental → Water → Unknown	EF 3.1	kg	2

Everything that changed this substance (56 changes)

Open the changes page

Flow object JSON

{
  "flow_object_id": "fo-973bfba9fa2c9078",
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      "@value": "Nonan-2-one",
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    {
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        "prov:wasDerivedFrom": "chebi synonym match"
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    },
    {
      "@value": "heptyl methyl ketone",
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    },
    {
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    {
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    {
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You do not need to run a build or clone anything. Name the record and say what your evidence is; the measurement is done for you. How contributing works

Nonan-2-one

Identity

Structure

Alternative labels

Properties

Known URLs

Elementary flows

History

Full record

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