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(S)-2-Phenyl-2-(4-phenyl-1H-1,2,3-triazol-1-yl)ethyl methanesulfonate
SpectraBase Compound ID E4M48qPoXij
InChI InChI=1S/C17H17N3O3S/c1-24(21,22)23-13-17(15-10-6-3-7-11-15)20-12-16(18-19-20)14-8-4-2-5-9-14/h2-12,17H,13H2,1H3/t17-/m1/s1
InChIKey OLYHUOCUBDCYKG-QGZVFWFLSA-N
Mol Weight 343.4 g/mol
Molecular Formula C17H17N3O3S
Exact Mass 343.099063 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4LGjEAbA7eh
Name (S)-2-Phenyl-2-(4-phenyl-1H-1,2,3-triazol-1-yl)ethyl methanesulfonate
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Formula C17H17N3O3S
InChI InChI=1S/C17H17N3O3S/c1-24(21,22)23-13-17(15-10-6-3-7-11-15)20-12-16(18-19-20)14-8-4-2-5-9-14/h2-12,17H,13H2,1H3/t17-/m1/s1
InChIKey OLYHUOCUBDCYKG-QGZVFWFLSA-N
Literature Reference DOI 10.1021/jo2016339
Molecular Weight 343.401 g/mol
SMILES [C@](c1ccccc1)([n]1cc(-c2ccccc2)nn1)(COS(C)(=O)=O)[H]
SPLASH splash10-0udi-2910000000-25e5807711e29861cc81
Source of Spectrum J-76-8404-(S)_8
Synonyms Methanesulfonic acid [(2S)-2-phenyl-2-(4-phenyl-1-triazolyl)ethyl] ester [(2S)-2-phenyl-2-(4-phenyltriazol-1-yl)ethyl] methanesulfonate [(2S)-2-phenyl-2-(4-phenyl-1,2,3-triazol-1-yl)ethyl] methanesulfonate
Wiley ID 1746926