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(3R,4S,5aR,8bR)(1S,5R,8S)-3-Hydroxy-2-(2-methyl-2-aza-3,7-dioxabicyclo[3.3.0]octyl)-2,3,5a,5b-tetrahydro[1,2]oxazolo[de]pyranocyclohexane

View entire compound with spectra: 1 MS (GC)

(3R,4S,5aR,8bR)(1S,5R,8S)-3-Hydroxy-2-(2-methyl-2-aza-3,7-dioxabicyclo[3.3.0]octyl)-2,3,5a,5b-tetrahydro[1,2]oxazolo[de]pyranocyclohexane
SpectraBase Compound ID IUeFuoBu1dY
InChI InChI=1S/C15H22N2O5/c1-17-12-7(6-20-17)5-19-14(12)15-13(18)11-10-8(21-15)3-2-4-9(10)22-16-11/h7-10,12-15,18H,2-6H2,1H3/t7-,8-,9?,10-,12+,13-,14+,15+/m1/s1
InChIKey ZXZNAPLRLJTKPP-NCOGGPALSA-N
Mol Weight 310.35 g/mol
Molecular Formula C15H22N2O5
Exact Mass 310.152872 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KiY7D8jxDvk
Name (3R,4S,5aR,8bR)(1S,5R,8S)-3-Hydroxy-2-(2-methyl-2-aza-3,7-dioxabicyclo[3.3.0]octyl)-2,3,5a,5b-tetrahydro[1,2]oxazolo[de]pyranocyclohexane
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H22N2O5
InChI InChI=1S/C15H22N2O5/c1-17-12-7(6-20-17)5-19-14(12)15-13(18)11-10-8(21-15)3-2-4-9(10)22-16-11/h7-10,12-15,18H,2-6H2,1H3/t7-,8-,9?,10-,12+,13-,14+,15+/m1/s1
InChIKey ZXZNAPLRLJTKPP-NCOGGPALSA-N
Molecular Weight 310.350 g/mol
SMILES O[C@]1([C@@]([C@@]2([C@]3(N(OC[C@@]3([H])CO2)C)[H])[H])(O[C@]2([C@]3(C1=NOC3CCC2)[H])[H])[H])[H]
SPLASH splash10-03di-0049000000-6192de8871570cb3ac0f
Source of Spectrum F-55-4131-28
Synonyms (3R,4S,5aR,8bR)-4-[(3aR,6S,6aS)-1-methyltetrahydro-1H,3H-furo[3,4-c]isoxazol-6-yl]-3,4,5a,6,7,8,8a,8b-octahydrochromeno[4,5-cd]isoxazol-3-ol 3-Hydroxy-2-(2-methyl-2-aza-3,7-dioxabicyclo[3.3.0]octyl)-2,3,5a,5b-tetrahydro[1,2]oxazolo[de]pyranocyclohexane
Wiley ID 837476