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1H-Indole-3-methanol, 2,3-dihydro-6-(phenylmethoxy)-1-(phenylsulfonyl)-, 3-methanesulfonate, (.+-.)-
SpectraBase Compound ID 3LaOpKk4Nyz
InChI InChI=1S/C23H23NO6S2/c1-31(25,26)30-17-19-15-24(32(27,28)21-10-6-3-7-11-21)23-14-20(12-13-22(19)23)29-16-18-8-4-2-5-9-18/h2-14,19H,15-17H2,1H3
InChIKey QWEVNXZRNWYXKU-UHFFFAOYSA-N
Mol Weight 473.56 g/mol
Molecular Formula C23H23NO6S2
Exact Mass 473.09668 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FzOKCcDinXf
Name 1H-Indole-3-methanol, 2,3-dihydro-6-(phenylmethoxy)-1-(phenylsulfonyl)-, 3-methanesulfonate, (.+-.)-
CAS Registry Number 119880-02-3
Comments Less than 3 mono-isotopic peaks
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Formula C23H23NO6S2
InChI InChI=1S/C23H23NO6S2/c1-31(25,26)30-17-19-15-24(32(27,28)21-10-6-3-7-11-21)23-14-20(12-13-22(19)23)29-16-18-8-4-2-5-9-18/h2-14,19H,15-17H2,1H3
InChIKey QWEVNXZRNWYXKU-UHFFFAOYSA-N
Molecular Weight 473.558 g/mol
SMILES c12N(S(=O)(=O)c3ccccc3)CC(c1ccc(c2)OCc1ccccc1)COS(=O)(=O)C
SPLASH splash10-0006-9000000000-c3b86bd6c4a5f3ebc0ec
Source of Spectrum C-112-5238-19
Synonyms 6-(benzyloxy)-3-(((methanesulfonyl)oxy)methyl)-1-(phenylsulfonyl)-indoline [6-(benzyloxy)-1-(phenylsulfonyl)-2,3-dihydro-1H-indol-3-yl]methyl methanesulfonate
Wiley ID 1393618