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(3aR,4aS,7aR,7bS,10aR)-2,3-Di(acetoxy)-2,3,3a,10a-tetrahydrofuran[4,5-b][1,2]oxazolo[ef]oxepanocyclohexane
SpectraBase Compound ID qhhjy8oISa
InChI InChI=1S/C16H21NO7/c1-7(18)20-15-14-12(23-16(15)21-8(2)19)6-9-13-10(22-14)4-3-5-11(13)24-17-9/h10-16H,3-6H2,1-2H3/t10-,11+,12+,13-,14-,15+,16?/m0/s1
InChIKey ZUADUPKXLSFYPQ-OZXANEEKSA-N
Mol Weight 339.34 g/mol
Molecular Formula C16H21NO7
Exact Mass 339.131802 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID E9ouDcTVgKC
Name (3aR,4aS,7aR,7bS,10aR)-2,3-Di(acetoxy)-2,3,3a,10a-tetrahydrofuran[4,5-b][1,2]oxazolo[ef]oxepanocyclohexane
Alternate Name(s) (2aR,5aS,6aS,9aR,10bS)-7-(acetyloxy)-2a,3,4,5,5a,7,8,9a,10,10b-decahydro-6aH-furo[2',3':6,7]oxepino[4,3,2-cd][1,2]benzisoxazol-8-yl acetate 2,3-Di(acetoxy)-2,3,3a,10a-tetrahydrofuran[4,5-b][1,2]oxazolo[ef]oxepanocyclohexane
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H21NO7
InChI InChI=1S/C16H21NO7/c1-7(18)20-15-14-12(23-16(15)21-8(2)19)6-9-13-10(22-14)4-3-5-11(13)24-17-9/h10-16H,3-6H2,1-2H3/t10-,11+,12+,13-,14-,15+,16?/m0/s1
InChIKey ZUADUPKXLSFYPQ-OZXANEEKSA-N
Molecular Weight 339.344 g/mol
SMILES [C@@]1([C@]2(O[C@@]3([C@]4([C@]([H])(ON=C4C[C@@]2([H])OC1OC(=O)C)CCC3)[H])[H])[H])(OC(=O)C)[H]
SPLASH splash10-001i-0092000000-7646314e81dcaf42498e
Source of Spectrum F-55-4129-16
Wiley ID 837480