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(Q76155487)
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English
(1S,2R)-2-methyl-1-(2-propan-2-ylphenyl)cyclohexan-1-ol
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
chemical compound
0 references
mass
232.182715388
dalton
1 reference
based on heuristic
inferred from isomeric SMILES
chemical formula
C₁₆H₂₄O
0 references
canonical SMILES
CC(C)c1ccccc1C1(O)CCCCC1C
1 reference
based on heuristic
inferred from isomeric SMILES
isomeric SMILES
C[C@@H]1CCCC[C@]1(C2=CC=CC=C2C(C)C)O
0 references
Identifiers
InChI
InChI=1S/C16H24O/c1-12(2)14-9-4-5-10-15(14)16(17)11-7-6-8-13(16)3/h4-5,9-10,12-13,17H,6-8,11H2,1-3H3/t13-,16+/m1/s1
0 references
InChIKey
QPBHJMJXTKYEFN-CJNGLKHVSA-N
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CAS Registry Number
73825-60-2
0 references
PubChem CID
3056661
1 reference
matched by identifier from
InChIKey
InChIKey
QPBHJMJXTKYEFN-CJNGLKHVSA-N
UniChem compound ID
54055971
1 reference
stated in
UniChem
DSSTox substance ID
DTXSID40224283
2 references
stated in
Mapping file of InChIStrings, InChIKeys and DTXSIDs for the EPA CompTox Dashboard
matched by identifier from
InChIKey
InChIKey
QPBHJMJXTKYEFN-CJNGLKHVSA-N
DSSTOX compound identifier
DTXCID40146774
0 references
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