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(S)-[2-[(2S)-2-(hydroxymethyl)pyrrolidin-1-yl]sulfonylphenyl]-(1-naphthyl)methanol
SpectraBase Compound ID 1Qy7dk1Wea7
InChI InChI=1S/C22H23NO4S/c24-15-17-9-6-14-23(17)28(26,27)21-13-4-3-11-20(21)22(25)19-12-5-8-16-7-1-2-10-18(16)19/h1-5,7-8,10-13,17,22,24-25H,6,9,14-15H2/t17-,22-/m0/s1
InChIKey RUASHBFLTUJWDS-JTSKRJEESA-N
Mol Weight 397.49 g/mol
Molecular Formula C22H23NO4S
Exact Mass 397.134779 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7Sc1gsTFHHi
Name (S)-[2-[(2S)-2-(hydroxymethyl)pyrrolidin-1-yl]sulfonylphenyl]-(1-naphthyl)methanol
Alternate Name(s) (S)-[2-[(2S)-2-(hydroxymethyl)pyrrolidin-1-yl]sulfonylphenyl]-naphthalen-1-yl-methanol (S)-[2-[(2S)-2-methylolpyrrolidino]sulfonylphenyl]-(1-naphthyl)methanol (S)-[2-[[(2S)-2-(hydroxymethyl)-1-pyrrolidinyl]sulfonyl]phenyl]-(1-naphthalenyl)methanol
Comments Less than 3 mono-isotopic peaks
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Formula C22H23NO4S
InChI InChI=1S/C22H23NO4S/c24-15-17-9-6-14-23(17)28(26,27)21-13-4-3-11-20(21)22(25)19-12-5-8-16-7-1-2-10-18(16)19/h1-5,7-8,10-13,17,22,24-25H,6,9,14-15H2/t17-,22-/m0/s1
InChIKey RUASHBFLTUJWDS-JTSKRJEESA-N
Molecular Weight 397.489 g/mol
SMILES OC[C@]1(N(S(c2c([C@](c3c4c(cccc4)ccc3)(O)[H])cccc2)(=O)=O)CCC1)[H]
SPLASH splash10-014i-0009000000-7fe1f0851a7efb1d6c95
Source of Spectrum E1-39-264-7
Wiley ID 1518694