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ID	http://purl.obolibrary.org/obo/CHEBI_59607 http://purl.obolibrary.org/obo/CHEBI_59607 https://agroportal.lirmm.fr/ontologies/ECTO/CHEBI_59607 Loading
Preferred name	quaternium-15
Synonyms	1-[3-chloroprop-2-en-1-yl]-3,5,7-triaza-1-azoniatricyclo[3.3.1.1(3),(7)]decanium chloride CTAC Hexamethylenetetramine chloroallyl chloride Methenamine 3-chloroallylochloride N-(3-Chloroallyl)hexaminium chloride quaternium 15 1-(3-chloro-2-propenyl)-3,5,7-triaza-1-azoniatricyclo(3.3.1.13,7)decane chloride 1-(3-Chloroallyl)-3,5,7-triaza-1-azoniaadamantane chloride
Definitions	A quaternary ammonium salt derived from hexamethylenetetramine; used as a preservative in many cosmetics and industrial substances. Also acts as a disinfectant and allergenic agent.

rdf:type	http://www.w3.org/2002/07/owl#Class Loading
rdfs:subClassOf	http://purl.obolibrary.org/obo/CHEBI_36683 Loading http://purl.obolibrary.org/obo/CHEBI_35273 Loading
rdfs:label	quaternium-15
skos:notation	CHEBI:59607
obo_purl:IAO_0000115	A quaternary ammonium salt derived from hexamethylenetetramine; used as a preservative in many cosmetics and industrial substances. Also acts as a disinfectant and allergenic agent.
oboinowl_gen:hasExactSynonym	1-[3-chloroprop-2-en-1-yl]-3,5,7-triaza-1-azoniatricyclo[3.3.1.1(3),(7)]decanium chloride
oboinowl_gen:hasDbXref	PMID:21616561 Beilstein:9300843 CAS:4080-31-3 PMID:15462465 PMID:20433443 PMID:20448270 PMID:22653068 PMID:26821003
oboinowl_gen:hasOBONamespace	chebi_ontology
oboinowl_gen:id	CHEBI:59607
oboinowl_gen:inSubset	http://purl.obolibrary.org/obo/chebi#3_STAR Loading
oboinowl_gen:hasRelatedSynonym	CTAC Hexamethylenetetramine chloroallyl chloride Methenamine 3-chloroallylochloride N-(3-Chloroallyl)hexaminium chloride quaternium 15 1-(3-chloro-2-propenyl)-3,5,7-triaza-1-azoniatricyclo(3.3.1.13,7)decane chloride 1-(3-Chloroallyl)-3,5,7-triaza-1-azoniaadamantane chloride
obo_purl:RO_0000087	http://purl.obolibrary.org/obo/CHEBI_33282 Loading http://purl.obolibrary.org/obo/CHEBI_48219 Loading http://purl.obolibrary.org/obo/CHEBI_50904 Loading http://purl.obolibrary.org/obo/CHEBI_59174 Loading
obo_purl:charge	0
obo_purl:formula	C9H16Cl2N4
obo_purl:inchi	InChI=1S/C9H16ClN4.ClH/c10-2-1-3-14-7-11-4-12(8-14)6-13(5-11)9-14;/h1-2H,3-9H2;1H/q+1;/p-1
obo_purl:inchikey	UKHVLWKBNNSRRR-UHFFFAOYSA-M
obo_purl:mass	251.15600
obo_purl:monoisotopicmass	250.07520
obo_purl:smiles	[Cl-].[H]C(Cl)=C([H])C[N+]12CN3CN(CN(C3)C1)C2
obo_purl:has_functional_parent	http://purl.obolibrary.org/obo/CHEBI_6824 Loading

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