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trans-4-[(Methoxycarbonyl)methyl]-3-methyl-1-p(toluenesulfonyl)pyrrolidin-3-ol
SpectraBase Compound ID IfkvhVThLIY
InChI InChI=1S/C15H21NO5S/c1-11-4-6-13(7-5-11)22(19,20)16-9-12(8-14(17)21-3)15(2,18)10-16/h4-7,12,18H,8-10H2,1-3H3/t12-,15+/m1/s1
InChIKey FDCGJGPLCUNWAZ-DOMZBBRYSA-N
Mol Weight 327.4 g/mol
Molecular Formula C15H21NO5S
Exact Mass 327.114044 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Ewb6PGnEGlf
Name trans-4-[(Methoxycarbonyl)methyl]-3-methyl-1-p(toluenesulfonyl)pyrrolidin-3-ol
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H21NO5S
InChI InChI=1S/C15H21NO5S/c1-11-4-6-13(7-5-11)22(19,20)16-9-12(8-14(17)21-3)15(2,18)10-16/h4-7,12,18H,8-10H2,1-3H3/t12-,15+/m1/s1
InChIKey FDCGJGPLCUNWAZ-DOMZBBRYSA-N
Molecular Weight 327.395 g/mol
SMILES O[C@]1(CN(S(c2ccc(cc2)C)(=O)=O)C[C@]1(CC(=O)OC)[H])C
SPLASH splash10-006x-4900000000-12a72ccdfb6772ce0061
Source of Spectrum J-59-1442-6
Synonyms Methyl {(3R,4R)-4-hydroxy-4-methyl-1-[(4-methylphenyl)sulfonyl]pyrrolidinyl}acetate
Wiley ID 1325406