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.alpha.-D-Glucofuranuronic acid, 5-deoxy-1,2-O-(1-methylethylidene)-5-[[(phenylmethoxy)carbonyl]amino]-, 1,1-dimethylethyl ester
SpectraBase Compound ID AudQcX4aMMZ
InChI InChI=1S/C21H29NO8/c1-20(2,3)29-17(24)13(22-19(25)26-11-12-9-7-6-8-10-12)15-14(23)16-18(27-15)30-21(4,5)28-16/h6-10,13-16,18,23H,11H2,1-5H3,(H,22,25)/t13-,14-,15+,16+,18+/m0/s1
InChIKey ZNVIHIHBLHJZPT-ZNFSNMQZSA-N
Mol Weight 423.46 g/mol
Molecular Formula C21H29NO8
Exact Mass 423.189317 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID wWjq4dvDWw
Name .alpha.-D-Glucofuranuronic acid, 5-deoxy-1,2-O-(1-methylethylidene)-5-[[(phenylmethoxy)carbonyl]amino]-, 1,1-dimethylethyl ester
Alternate Name(s) (t-butyl) ester of 5-benzyloxycarbonylamino-5-desoxy-1,2-O-isopropylidene-.alpha.-D-glucofuranuronoic acid Furo[2,3-d]-1,3-dioxole, .alpha.-D-glucofuranuronic acid deriv. tert-Butyl 5-{[(benzyloxy)carbonyl]amino}-5-deoxy-1,2-O-(1-methylethylidene)-.alpha.-D-glucofuranuronate
CAS Registry Number 84043-09-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H29NO8
InChI InChI=1S/C21H29NO8/c1-20(2,3)29-17(24)13(22-19(25)26-11-12-9-7-6-8-10-12)15-14(23)16-18(27-15)30-21(4,5)28-16/h6-10,13-16,18,23H,11H2,1-5H3,(H,22,25)/t13-,14-,15+,16+,18+/m0/s1
InChIKey ZNVIHIHBLHJZPT-ZNFSNMQZSA-N
Molecular Weight 423.462 g/mol
SMILES N([C@@]([C@]1(O[C@@]2(OC(O[C@@]2([C@]1(O)[H])[H])(C)C)[H])[H])(C(OC(C)(C)C)=O)[H])C(=O)OCc1ccccc1
SPLASH splash10-052f-9100000000-921e571c4d895783e817
Source of Spectrum H-65-1141-0
Wiley ID 1378924