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(2R(*),3S(*),4R(*))-3-Acetoxy-2-(benzyloxy)-4-(ethoxycarbonyl)-1-(phenylsulfonyl)-1,2,3,4-tetrahydropyridine
SpectraBase Compound ID EGN1nOTVBz6
InChI InChI=1S/C23H25NO7S/c1-3-29-23(26)20-14-15-24(32(27,28)19-12-8-5-9-13-19)22(21(20)31-17(2)25)30-16-18-10-6-4-7-11-18/h4-15,20-22H,3,16H2,1-2H3/t20-,21-,22+/m0/s1
InChIKey NTOWXSSGLLFKHY-FDFHNCONSA-N
Mol Weight 459.51 g/mol
Molecular Formula C23H25NO7S
Exact Mass 459.135173 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CJZ09tNpipm
Name (2R(*),3S(*),4R(*))-3-Acetoxy-2-(benzyloxy)-4-(ethoxycarbonyl)-1-(phenylsulfonyl)-1,2,3,4-tetrahydropyridine
CAS Registry Number 130146-95-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C23H25NO7S
InChI InChI=1S/C23H25NO7S/c1-3-29-23(26)20-14-15-24(32(27,28)19-12-8-5-9-13-19)22(21(20)31-17(2)25)30-16-18-10-6-4-7-11-18/h4-15,20-22H,3,16H2,1-2H3/t20-,21-,22+/m0/s1
InChIKey NTOWXSSGLLFKHY-FDFHNCONSA-N
Molecular Weight 459.513 g/mol
SMILES c1(S(N2[C@@]([C@@](OC(=O)C)([C@](C=C2)(C(=O)OCC)[H])[H])(OCc2ccccc2)[H])(=O)=O)ccccc1
SPLASH splash10-0006-9010000000-bcb8d43b75c7483c8dbc
Source of Spectrum C-113-1728-46
Synonyms (2R(*),3S(*),4S(*))-3-Acetoxy-2-(benzyloxy)-4-(ethoxycarbonyl)-1-(phenylsulfonyl)-1,2,3,4-tetrahydropyridine Ethyl (2R,3S,4S)-3-(acetyloxy)-2-(benzyloxy)-1-(phenylsulfonyl)-1,2,3,4-tetrahydro-4-pyridinecarboxylate
Wiley ID 1390199