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4-[5-(3,4-dimethylphenoxy)-1,2,3,4-tetrazol-1-yl]benzoic acid
SpectraBase Compound ID LpzGbNmKxJ7
InChI InChI=1S/C16H14N4O3/c1-10-3-8-14(9-11(10)2)23-16-17-18-19-20(16)13-6-4-12(5-7-13)15(21)22/h3-9H,1-2H3,(H,21,22)
InChIKey ZYWUMBBTHJFCJT-UHFFFAOYSA-N
Mol Weight 310.31 g/mol
Molecular Formula C16H14N4O3
Exact Mass 310.10659 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID B04cdAjje8c
Name 4-[5-(3,4-dimethylphenoxy)-1,2,3,4-tetrazol-1-yl]benzoic acid
Alternate Name(s) 4-[5-(3,4-dimethylphenoxy)-1-tetrazolyl]benzoic acid 4-[5-(3,4-dimethylphenoxy)tetrazol-1-yl]benzoic acid Benzoic acid, 4-[5-(3,4-dimethylphenoxy)-1H-1,2,3,4-tetrazol-1-yl]-
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Formula C16H14N4O3
InChI InChI=1S/C16H14N4O3/c1-10-3-8-14(9-11(10)2)23-16-17-18-19-20(16)13-6-4-12(5-7-13)15(21)22/h3-9H,1-2H3,(H,21,22)
InChIKey ZYWUMBBTHJFCJT-UHFFFAOYSA-N
Molecular Weight 310.313 g/mol
SMILES OC(c1ccc(-[n]2c(Oc3cc(c(cc3)C)C)nnn2)cc1)=O
SPLASH splash10-024l-9500000000-e65ecd212e43f83813d0
Wiley ID 1448323