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(Q82853355)
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English
4-(~2~H_3_)Methyl(4,5,5,5-~2~H_4_)pentan-1-ol
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
109.14840228999998
dalton
1 reference
based on heuristic
inferred from InChI
chemical formula
C₆H₁₄O
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canonical SMILES
[2H]C([2H])([2H])C([2H])(CCCO)C([2H])([2H])[2H]
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Identifiers
InChI
InChI=1S/C6H14O/c1-6(2)4-3-5-7/h6-7H,3-5H2,1-2H3/i1D3,2D3,6D
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InChIKey
PCWGTDULNUVNBN-NWOXSKRJSA-N
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CAS Registry Number
1246819-30-6
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PubChem CID
71749564
1 reference
matched by identifier from
InChIKey
InChIKey
PCWGTDULNUVNBN-NWOXSKRJSA-N
UniChem compound ID
22918038
1 reference
stated in
UniChem
DSSTox substance ID
DTXSID50857884
1 reference
matched by identifier from
InChIKey
InChIKey
PCWGTDULNUVNBN-NWOXSKRJSA-N
DSSTOX compound identifier
DTXCID60808625
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