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(2R,3R,4R,4aR,4bR,5S.6S,9aR)-3,4,6-Trihydroxy-2-(hydroxymethyl)5-tert-butyl-octahydro-2H-pyrano[3,2-d]pyrrolo[1,2-b]isoxazole

View entire compound with spectra: 1 MS (GC)

(2R,3R,4R,4aR,4bR,5S.6S,9aR)-3,4,6-Trihydroxy-2-(hydroxymethyl)5-tert-butyl-octahydro-2H-pyrano[3,2-d]pyrrolo[1,2-b]isoxazole
SpectraBase Compound ID 6ZGcJOWsjVs
InChI InChI=1S/C14H25NO7/c1-14(2,3)21-12-6(17)4-15-9(12)8-11(19)10(18)7(5-16)20-13(8)22-15/h6-13,16-19H,4-5H2,1-3H3/t6-,7+,8-,9+,10-,11+,12+,13?/m0/s1
InChIKey UQPPKPYDTWWAOU-VDYNOAFQSA-N
Mol Weight 319.35 g/mol
Molecular Formula C14H25NO7
Exact Mass 319.163102 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5GC1AFoCaGU
Name (2R,3R,4R,4aR,4bR,5S.6S,9aR)-3,4,6-Trihydroxy-2-(hydroxymethyl)5-tert-butyl-octahydro-2H-pyrano[3,2-d]pyrrolo[1,2-b]isoxazole
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H25NO7
InChI InChI=1S/C14H25NO7/c1-14(2,3)21-12-6(17)4-15-9(12)8-11(19)10(18)7(5-16)20-13(8)22-15/h6-13,16-19H,4-5H2,1-3H3/t6-,7+,8-,9+,10-,11+,12+,13?/m0/s1
InChIKey UQPPKPYDTWWAOU-VDYNOAFQSA-N
Molecular Weight 319.354 g/mol
SMILES O[C@]1(CN2[C@]([C@]3([C@]([C@]([C@@](CO)(OC3O2)[H])(O)[H])(O)[H])[H])([C@@]1(OC(C)(C)C)[H])[H])[H]
SPLASH splash10-0a4j-9000000000-035e2340be6259249e18
Source of Spectrum J-63-7317-31
Wiley ID 1319207