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MFCD00059322 molecular structure
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2-phenylethyl 4-methylbenzene-1-sulfonate

ChemBase ID: 45316
Molecular Formular: C15H16O3S
Molecular Mass: 276.35074
Monoisotopic Mass: 276.08201537
SMILES and InChIs

SMILES:
S(=O)(=O)(c1ccc(cc1)C)OCCc1ccccc1
Canonical SMILES:
Cc1ccc(cc1)S(=O)(=O)OCCc1ccccc1
InChI:
InChI=1S/C15H16O3S/c1-13-7-9-15(10-8-13)19(16,17)18-12-11-14-5-3-2-4-6-14/h2-10H,11-12H2,1H3
InChIKey:
CVPPUZPZPFOFPK-UHFFFAOYSA-N

Cite this record

CBID:45316 http://www.chembase.cn/molecule-45316.html

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