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1H-Indole-1-carboxylic acid, 2,3-dihydro-3-[[(methylsulfonyl)oxy]methyl]-6-(phenylmethoxy)-, 1,1-dimethylethyl ester, (R)-
SpectraBase Compound ID Fyn3OYscyuP
InChI InChI=1S/C22H27NO6S/c1-22(2,3)29-21(24)23-13-17(15-28-30(4,25)26)19-11-10-18(12-20(19)23)27-14-16-8-6-5-7-9-16/h5-12,17H,13-15H2,1-4H3/t17-/m1/s1
InChIKey PEIZGWKFNDGQPX-QGZVFWFLSA-N
Mol Weight 433.52 g/mol
Molecular Formula C22H27NO6S
Exact Mass 433.155909 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BRmjn3Stjon
Name 1H-Indole-1-carboxylic acid, 2,3-dihydro-3-[[(methylsulfonyl)oxy]methyl]-6-(phenylmethoxy)-, 1,1-dimethylethyl ester, (R)-
CAS Registry Number 128049-48-9
Comments Less than 3 mono-isotopic peaks
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Formula C22H27NO6S
InChI InChI=1S/C22H27NO6S/c1-22(2,3)29-21(24)23-13-17(15-28-30(4,25)26)19-11-10-18(12-20(19)23)27-14-16-8-6-5-7-9-16/h5-12,17H,13-15H2,1-4H3/t17-/m1/s1
InChIKey PEIZGWKFNDGQPX-QGZVFWFLSA-N
Molecular Weight 433.519 g/mol
SMILES c12N(C[C@@](c2ccc(c1)OCc1ccccc1)(COS(=O)(=O)C)[H])C(OC(C)(C)C)=O
SPLASH splash10-0006-9000000000-dbbada268f169f126dfd
Source of Spectrum C-112-5238-19
Synonyms 6-(benzyloxy)-1-((tert-butyloxy)carbonyl)-3-(((methanesulfonyl)oxy)methyl)indoline tert-butyl (3R)-6-(benzyloxy)-3-{[(methylsulfonyl)oxy]methyl}-2,3-dihydro-1H-indole-1-carboxylate
Wiley ID 1382648