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2-Oxa-5-azabicyclo[2.2.2]octane-5-carboxylic acid, 7,8-bis(acetyloxy)-3-methoxy-, phenylmethyl ester, [1R-(1.alpha.,3.alpha.,4.alpha.,7R*,8S*)]-
SpectraBase Compound ID GXWW7pzCaYy
InChI InChI=1S/C19H23NO8/c1-11(21)26-16-14-9-20(19(23)25-10-13-7-5-4-6-8-13)15(18(24-3)28-14)17(16)27-12(2)22/h4-8,14-18H,9-10H2,1-3H3/t14-,15-,16-,17+,18+/m1/s1
InChIKey UEBCOXRDSNOXRT-DZVNLGKHSA-N
Mol Weight 393.39 g/mol
Molecular Formula C19H23NO8
Exact Mass 393.142367 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6U7edxt5zxp
Name 2-Oxa-5-azabicyclo[2.2.2]octane-5-carboxylic acid, 7,8-bis(acetyloxy)-3-methoxy-, phenylmethyl ester, [1R-(1.alpha.,3.alpha.,4.alpha.,7R*,8S*)]-
CAS Registry Number 120191-63-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H23NO8
InChI InChI=1S/C19H23NO8/c1-11(21)26-16-14-9-20(19(23)25-10-13-7-5-4-6-8-13)15(18(24-3)28-14)17(16)27-12(2)22/h4-8,14-18H,9-10H2,1-3H3/t14-,15-,16-,17+,18+/m1/s1
InChIKey UEBCOXRDSNOXRT-DZVNLGKHSA-N
Molecular Weight 393.392 g/mol
SMILES [C@@]12(N(C[C@]([C@]([C@]2(OC(=O)C)[H])(OC(=O)C)[H])(O[C@@]1(OC)[H])[H])C(OCc1ccccc1)=O)[H]
SPLASH splash10-0006-9000000000-171392ac3870ee8f6e45
Source of Spectrum F-44-6161-15
Synonyms benzyl (1R,3S,4R,7R,8S)-7,8-bis(acetyloxy)-3-methoxy-2-oxa-5-azabicyclo[2.2.2]octane-5-carboxylate Methyl 3,4-di-O-acetyl-2,6-benzyloxycarbonylimino-2,6-dideoxy-.alpha.-D-altropyranoside
Wiley ID 1366204