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(R)-[2-[(2S)-2-(hydroxymethyl)pyrrolidin-1-yl]sulfonylphenyl]-phenyl-methanol
SpectraBase Compound ID DkdV5mz10MV
InChI InChI=1S/C18H21NO4S/c20-13-15-9-6-12-19(15)24(22,23)17-11-5-4-10-16(17)18(21)14-7-2-1-3-8-14/h1-5,7-8,10-11,15,18,20-21H,6,9,12-13H2/t15-,18+/m0/s1
InChIKey ZNFGDVXBQOKRHM-MAUKXSAKSA-N
Mol Weight 347.43 g/mol
Molecular Formula C18H21NO4S
Exact Mass 347.119129 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8mtoLzYIzW7
Name (R)-[2-[(2S)-2-(hydroxymethyl)pyrrolidin-1-yl]sulfonylphenyl]-phenyl-methanol
Alternate Name(s) (R)-[2-[(2S)-2-methylolpyrrolidino]sulfonylphenyl]-phenyl-methanol (R)-[2-[[(2S)-2-(hydroxymethyl)-1-pyrrolidinyl]sulfonyl]phenyl]-phenylmethanol
Comments Less than 3 mono-isotopic peaks
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Formula C18H21NO4S
InChI InChI=1S/C18H21NO4S/c20-13-15-9-6-12-19(15)24(22,23)17-11-5-4-10-16(17)18(21)14-7-2-1-3-8-14/h1-5,7-8,10-11,15,18,20-21H,6,9,12-13H2/t15-,18+/m0/s1
InChIKey ZNFGDVXBQOKRHM-MAUKXSAKSA-N
Molecular Weight 347.429 g/mol
SMILES OC[C@]1(N(S(c2c([C@@](c3ccccc3)(O)[H])cccc2)(=O)=O)CCC1)[H]
SPLASH splash10-014i-0009000000-e0528de99225a74146fb
Source of Spectrum E1-39-264-7
Wiley ID 1518697