CAS
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Specification
The molecular formula is C10H12O2.
The molecular weight is 164.20 g/mol.
The IUPAC name is 3-propan-2-yloxybenzaldehyde.
The InChI is InChI=1S/C10H12O2/c1-8(2)12-10-5-3-4-9(6-10)7-11/h3-8H,1-2H3.
The InChIKey is NOBKCEXLDDGYID-UHFFFAOYSA-N.
The canonical SMILES is CC(C)OC1=CC=CC(=C1)C=O.
The CAS number is 75792-33-5.
The European Community (EC) number is 672-084-2.
The DSSTox Substance ID is DTXSID10351898.
Yes, it is canonicalized according to PubChem.