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5-Chloro-7-(hydroxycarbonyl)-2-(t-butyl)benzoxazole
SpectraBase Compound ID 8YIgpIj2WC4
InChI InChI=1S/C12H12ClNO3/c1-12(2,3)11-14-8-5-6(13)4-7(10(15)16)9(8)17-11/h4-5H,1-3H3,(H,15,16)
InChIKey KTNJDCBBUMQMIY-UHFFFAOYSA-N
Mol Weight 253.68 g/mol
Molecular Formula C12H12ClNO3
Exact Mass 253.050571 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GKnMbIg3jaI
Name 5-Chloro-7-(hydroxycarbonyl)-2-(t-butyl)benzoxazole
Alternate Name(s) 2-(tert-butyl)-5-chlorobenzo[d]oxazole-7-carboxylic acid 2-Tert-butyl-5-chloranyl-1,3-benzoxazole-7-carboxylic acid
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Formula C12H12ClNO3
InChI InChI=1S/C12H12ClNO3/c1-12(2,3)11-14-8-5-6(13)4-7(10(15)16)9(8)17-11/h4-5H,1-3H3,(H,15,16)
InChIKey KTNJDCBBUMQMIY-UHFFFAOYSA-N
Molecular Weight 253.685 g/mol
SMILES OC(c1cc(Cl)cc2c1oc(n2)C(C)(C)C)=O
SPLASH splash10-0a4i-6090000000-6b494b4a17a1ab33f2cb
Source of Spectrum SK-20-1433-8b
Wiley ID 1733780