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Benzoxazole-[13C6]

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General Information
Catalog: BLP-000055
CAS: 1216500-18-3
Molecular Formula: C[13C]6H5NO
Molecular Weight: 125.08

Chemical Structure

Synonyms	Benz-13C6-oxazole
IUPAC Name	benzo[d]oxazole-3a,4,5,6,7,7a-13C6
Related CAS	273-53-0 (unlabelled)
Isomeric SMILES	C1=N[13C]2=[13CH][13CH]=[13CH][13CH]=[13C]2O1
Canonical SMILES	C1=CC=C2C(=C1)N=CO2
InChI	InChI=1S/C7H5NO/c1-2-4-7-6(3-1)8-5-9-7/h1-5H/i1+1,2+1,3+1,4+1,6+1,7+1
InChI Key	BCMCBBGGLRIHSE-KSYPSEKYSA-N
Boiling Point	182 °C (lit.)
Melting Point	27-30 °C (lit.)
Purity	99% atom 13C
Appearance	Solid
Storage	Store at 2-8°C