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1-Pyrrolidinecarboxylic acid, 2-[3,4,5-tris(acetyloxy)tetrahydro-2-furanyl]-, phenylmethyl ester, [2R-[2.alpha.(R*),3.alpha.,4.beta.,5.beta.]]-
SpectraBase Compound ID IM38sKdfqzD
InChI InChI=1S/C22H27NO9/c1-13(24)29-19-18(32-21(31-15(3)26)20(19)30-14(2)25)17-10-7-11-23(17)22(27)28-12-16-8-5-4-6-9-16/h4-6,8-9,17-21H,7,10-12H2,1-3H3/t17-,18?,19-,20+,21-/m1/s1
InChIKey AEKYYKZAJVCAHK-JPGZLTHCSA-N
Mol Weight 449.46 g/mol
Molecular Formula C22H27NO9
Exact Mass 449.168581 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EdTrVJ4CLVz
Name 1-Pyrrolidinecarboxylic acid, 2-[3,4,5-tris(acetyloxy)tetrahydro-2-furanyl]-, phenylmethyl ester, [2R-[2.alpha.(R*),3.alpha.,4.beta.,5.beta.]]-
Alternate Name(s) 1,2,3-Triacetoxy-5,8-benzyloxycarbonylimino-5,6,7,8-tetradeoxy-D-gluco-octose benzyl (2R)-2-[(3R,4S,5S)-3,4,5-tris(acetyloxy)tetrahydro-2-furanyl]-1-pyrrolidinecarboxylate
CAS Registry Number 120191-68-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H27NO9
InChI InChI=1S/C22H27NO9/c1-13(24)29-19-18(32-21(31-15(3)26)20(19)30-14(2)25)17-10-7-11-23(17)22(27)28-12-16-8-5-4-6-9-16/h4-6,8-9,17-21H,7,10-12H2,1-3H3/t17-,18?,19-,20+,21-/m1/s1
InChIKey AEKYYKZAJVCAHK-JPGZLTHCSA-N
Molecular Weight 449.456 g/mol
SMILES C1([C@]([C@](OC(=O)C)([C@@](O1)(OC(=O)C)[H])[H])(OC(=O)C)[H])[C@@]1(N(C(OCc2ccccc2)=O)CCC1)[H]
SPLASH splash10-0006-9100000000-dddc6fe141320a195473
Source of Spectrum F-44-6150-23
Wiley ID 1387422