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Methyl (2RS,3RS,3aSR)-2-[(1RS)-3-(Benzyloxy)-1-(mesyloxy)propyl]hexahydro-2H-isoxazolo[2,3-a]pyridine-3-carboxylate
SpectraBase Compound ID 5KLX0blk3kr
InChI InChI=1S/C20H29NO7S/c1-25-20(22)18-16-10-6-7-12-21(16)27-19(18)17(28-29(2,23)24)11-13-26-14-15-8-4-3-5-9-15/h3-5,8-9,16-19H,6-7,10-14H2,1-2H3
InChIKey IOSXITRFGONYKJ-UHFFFAOYSA-N
Mol Weight 427.51 g/mol
Molecular Formula C20H29NO7S
Exact Mass 427.166473 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4ZFwAxpKV7R
Name Methyl (2RS,3RS,3aSR)-2-[(1RS)-3-(Benzyloxy)-1-(mesyloxy)propyl]hexahydro-2H-isoxazolo[2,3-a]pyridine-3-carboxylate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H29NO7S
InChI InChI=1S/C20H29NO7S/c1-25-20(22)18-16-10-6-7-12-21(16)27-19(18)17(28-29(2,23)24)11-13-26-14-15-8-4-3-5-9-15/h3-5,8-9,16-19H,6-7,10-14H2,1-2H3
InChIKey IOSXITRFGONYKJ-UHFFFAOYSA-N
Molecular Weight 427.512 g/mol
SMILES C1(C(C2CCCCN2O1)C(=O)OC)C(OS(=O)(=O)C)CCOCc1ccccc1
SPLASH splash10-000x-9100000000-8ccbbdf1ef65e2e8f507
Source of Spectrum J-61-8584-16
Synonyms Methyl (2RS,3RS,3aSR)-2-[(1SR)-3-(Benzyloxy)-1-(mesyloxy)propyl]hexahydro-2H-isoxazolo[2,3-a]pyridine-3-carboxylate Methyl 2-{3-(benzyloxy)-1-[(methylsulfonyl)oxy]propyl}hexahydro-2H-isoxazolo[2,3-a]pyridine-3-carboxylate
Wiley ID 1380346