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(Q63409512)
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English
1-(hydroxymethyl)-1-methanimidoyl-3-propyl-3-[2-(2,4,6-trichlorophenoxy)ethyl]urea
chemical compound
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Statements
instance of
type of chemical entity
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subclass of
chemical compound
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mass
381.041374476
dalton
1 reference
based on heuristic
inferred from InChI
chemical formula
C₁₄H₁₈Cl₃N₃O₃
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canonical SMILES
CCCN(CCOC1=C(C=C(C=C1Cl)Cl)Cl)C(=O)N(CO)C=N
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Identifiers
InChI
InChI=1S/C14H18Cl3N3O3/c1-2-3-19(14(22)20(8-18)9-21)4-5-23-13-11(16)6-10(15)7-12(13)17/h6-8,18,21H,2-5,9H2,1H3
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InChIKey
LRLDLEGEIWYGJQ-UHFFFAOYSA-N
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PubChem CID
133052770
1 reference
matched by identifier from
InChIKey
InChIKey
LRLDLEGEIWYGJQ-UHFFFAOYSA-N
UniChem compound ID
165115260
1 reference
stated in
UniChem
MassBank accession ID
MSBNK-Eawag_Additional_Specs-ET201201
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MSBNK-Eawag_Additional_Specs-ET201202
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MSBNK-Eawag_Additional_Specs-ET201203
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MSBNK-Eawag_Additional_Specs-ET201204
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MSBNK-Eawag_Additional_Specs-ET201205
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DSSTox substance ID
DTXSID20891614
1 reference
matched by identifier from
InChIKey
InChIKey
LRLDLEGEIWYGJQ-UHFFFAOYSA-N
DSSTOX compound identifier
DTXCID401030707
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