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(Q82022272)
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English
2,5,5-trimethyl-2-(4-methylphenyl)-1,3-dioxane
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
220.3079
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₁₄H₂₀O₂
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canonical SMILES
CC1=CC=C(C=C1)C2(OCC(CO2)(C)C)C
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Identifiers
InChI
InChI=1S/C14H20O2/c1-11-5-7-12(8-6-11)14(4)15-9-13(2,3)10-16-14/h5-8H,9-10H2,1-4H3
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InChIKey
YPYOQGDGRVXQQA-UHFFFAOYSA-N
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CAS Registry Number
6340-94-9
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PubChem CID
240224
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UniChem compound ID
17888867
1 reference
stated in
UniChem
DSSTox substance ID
DTXSID50286514
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DSSTOX compound identifier
DTXCID10237663
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NSC number
46300
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58669
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