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The molecular formula is C10H10N2O.
The molecular weight is 174.20 g/mol.
The IUPAC Name is 5-isocyanato-1-methyl-2,3-dihydroindole.
The InChI is InChI=1S/C10H10N2O/c1-12-5-4-8-6-9(11-7-13)2-3-10(8)12/h2-3,6H,4-5H2,1H3.
The InChIKey is ZHBVXJDYCNQFSO-UHFFFAOYSA-N.
The Canonical SMILES is CN1CCC2=C1C=CC(=C2)N=C=O.
The CAS number is 921938-71-8.
The Monoisotopic Mass is 174.079312947 g/mol.
It has 3 hydrogen bond acceptors.
Yes, it is a canonicalized compound.
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921938-65-0
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921938-75-2
921938-77-4
921938-78-5
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