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4-(Benzooxazol-2-ylsulfanylmethyl)-benzoic acid
SpectraBase Compound ID FEsPPIKgQVY
InChI InChI=1S/C15H11NO3S/c17-14(18)11-7-5-10(6-8-11)9-20-15-16-12-3-1-2-4-13(12)19-15/h1-8H,9H2,(H,17,18)
InChIKey XCKAGLDDLJTRBV-UHFFFAOYSA-N
Mol Weight 285.32 g/mol
Molecular Formula C15H11NO3S
Exact Mass 285.045964 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID ATR93Oc0fHp
Name 4-(Benzooxazol-2-ylsulfanylmethyl)-benzoic acid
Alternate Name(s) 4-(1,3-benzoxazol-2-ylsulfanylmethyl)benzoic acid 4-[(1,3-benzoxazol-2-ylthio)methyl]benzoic acid
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Formula C15H11NO3S
InChI InChI=1S/C15H11NO3S/c17-14(18)11-7-5-10(6-8-11)9-20-15-16-12-3-1-2-4-13(12)19-15/h1-8H,9H2,(H,17,18)
InChIKey XCKAGLDDLJTRBV-UHFFFAOYSA-N
Molecular Weight 285.317 g/mol
SMILES OC(c1ccc(CSc2nc3ccccc3o2)cc1)=O
SPLASH splash10-000i-5930000000-699746cb0c8c86c2cf0c
Wiley ID 1461135