6-acetyl-1,1,2,4,4,7-hexamethyltetraline

Property	Value
InChI2D key string chemrof:inchi2d_key_string	DNRJTBAOUJJKDY-UHFFFAOYSA-N
InChI2D string chemrof:inchi2d_string	InChI=1S/C18H26O/c1-11-8-16-15(9-14(11)13(3)19)17(4,5)10-12(2)18(16,6)7/h8-9,12H,10H2,1-7H3
IUPAC name chemrof:IUPAC_name	6-acetyl-1,1,2,4,4,7-hexamethyltetraline
Molecular formula chemrof:molecular_formula	C18H26O
Molecular mass chemrof:molecular_mass	258.405
Monoisotopic mass chemrof:monoisotopic_mass	258.198365
SMILES string chemrof:smiles_string	CC(=O)c1cc2c(cc1C)C(C)(C)C(C)CC2(C)C

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
CAS Common Chemistry	https://commonchemistry.cas.org/detail?cas_rn=1506-02-1	enrich_references.consensus_cas_link
ChEBI	https://www.ebi.ac.uk/chebi/searchId.do?chebiId=CHEBI:88666	enrich_references.pubchem_identifier_url
chem.echa.europa.eu	https://chem.echa.europa.eu/100.014.667	enrich_references.pubchem_identifier_url
chem.echa.europa.eu	https://chem.echa.europa.eu/100.040.203	enrich_references.pubchem_identifier_url
comptox.epa.gov	https://comptox.epa.gov/dashboard/DTXSID7041544	enrich_references.pubchem_identifier_url
dtp.cancer.gov	https://dtp.cancer.gov/dtpstandard/servlet/dwindex?searchtype=NSC&outputformat=html&searchlist=19550	enrich_references.pubchem_identifier_url
ebi.ac.uk	https://www.ebi.ac.uk/chembl/explore/compound/CHEMBL3184267	enrich_references.pubchem_identifier_url
gsrs.ncats.nih.gov	https://gsrs.ncats.nih.gov/ginas/app/beta/substances/360Q8Z01IP	enrich_references.pubchem_identifier_url
HMDB	https://hmdb.ca/metabolites/HMDB0061860	enrich_references.pubchem_identifier_url
jglobal.jst.go.jp	http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J16.863G	enrich_references.pubchem_identifier_url
metabolomicsworkbench.org	https://www.metabolomicsworkbench.org/data/StructureData.php?RegNo=130626	enrich_references.pubchem_identifier_url
PubChem	https://pubchem.ncbi.nlm.nih.gov/compound/89440	enrich_references.pubchem_compound
rxnav.nlm.nih.gov	https://rxnav.nlm.nih.gov/id/rxnorm/2289007	enrich_references.pubchem_identifier_url
Wikidata	https://www.wikidata.org/wiki/Q2409972	enrich_references.pubchem_identifier_url

Flow	Context	Source	Unit	CFs
ceb64799-8758-40ab-b58a-4833812ee400	Environmental → Air → Aircraft cruise height	EF 3.1	kg	4
41b8d160-d919-498e-92cd-5ba08e0956dc	Environmental → Air → Ground level → Urban (>1000 people/square mile)	EF 3.1	kg	4
929a5059-5bc3-4254-9e40-ff322edef295	Environmental → Air → Indoor	EF 3.1	kg	4
54ea86db-f419-49c5-b70f-cbbba182a21c	Environmental → Air → Long-term	EF 3.1	kg	0
48c0cbfa-4ba6-4449-a355-dfd17f1f5b20	Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile)	EF 3.1	kg	4
9c9ecb59-39d8-4bcd-8bdc-add94ab1043c	Environmental → Air → Unknown	EF 3.1	kg	4
d4cbda50-32ae-4056-88a8-931481db0e0c	Environmental → Ground → Agricultural	EF 3.1	kg	4
c1752437-ada7-4681-ad6f-f62bb109eacf	Environmental → Ground → Non-agricultural	EF 3.1	kg	4
06d665ac-3816-44e5-b151-df74497e323e	Environmental → Ground → Unknown	EF 3.1	kg	4
224f231a-ee21-42d1-a8f1-15353d87b0a2	Environmental → Water → Long-term	EF 3.1	kg	0
a2077bcd-225b-4c8e-be43-4e31643f70ec	Environmental → Water → Ocean	EF 3.1	kg	4
4286db72-cdc0-4fcf-a2af-45da77ac0d66	Environmental → Water → Surface water	EF 3.1	kg	4
1bc989ad-319f-4291-8085-5d8db72f7b3c	Environmental → Water → Unknown	EF 3.1	kg	4

Everything that changed this substance (53 changes)

Open the changes page

Flow object JSON

{
  "flow_object_id": "fo-298e732a1ab9a911",
  "prefLabel": [
    {
      "@value": "6-acetyl-1,1,2,4,4,7-hexamethyltetraline",
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  "altLabel": [],
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}

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6-acetyl-1,1,2,4,4,7-hexamethyltetraline

Identity

Structure

Properties

Known URLs

Elementary flows

History

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