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(Q81999855)
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English
1-Propanone, 2-hydroxy-2-methyl-1-[4-(1-methylethyl)phenyl]-
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
chemical compound
0 references
mass
206.130679816
dalton
1 reference
based on heuristic
inferred from InChI
chemical formula
C₁₃H₁₈O₂
0 references
canonical SMILES
CC(C)C1=CC=C(C=C1)C(=O)C(C)(C)O
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Identifiers
InChI
InChI=1S/C13H18O2/c1-9(2)10-5-7-11(8-6-10)12(14)13(3,4)15/h5-9,15H,1-4H3
0 references
InChIKey
QPXVRLXJHPTCPW-UHFFFAOYSA-N
0 references
CAS Registry Number
69673-85-4
1 reference
InChIKey
QPXVRLXJHPTCPW-UHFFFAOYSA-N
stated in
CAS Common Chemistry
retrieved
9 April 2021
reference URL
https://commonchemistry.cas.org/detail?cas_rn=69673-85-4
PubChem CID
112291
1 reference
matched by identifier from
InChIKey
InChIKey
QPXVRLXJHPTCPW-UHFFFAOYSA-N
SureChEMBL ID
SCHEMBL54909
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
QPXVRLXJHPTCPW-UHFFFAOYSA-N
UniChem compound ID
25992599
1 reference
stated in
UniChem
DSSTox substance ID
DTXSID2071990
1 reference
matched by identifier from
InChIKey
InChIKey
QPXVRLXJHPTCPW-UHFFFAOYSA-N
DSSTOX compound identifier
DTXCID2046543
0 references
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