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(1-R,2-R,3-S,4-S,5-S,6-S)-5-ACETAMIDO-1-(HYDROXYMETHYL)-BICYCLO-[4.1.0]-2,3,4-HEPTANETRIOL

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(1-R,2-R,3-S,4-S,5-S,6-S)-5-ACETAMIDO-1-(HYDROXYMETHYL)-BICYCLO-[4.1.0]-2,3,4-HEPTANETRIOL
SpectraBase Compound ID 4lhlMPvLrjx
InChI InChI=1S/C10H17NO5/c1-4(13)11-6-5-2-10(5,3-12)9(16)8(15)7(6)14/h5-9,12,14-16H,2-3H2,1H3,(H,11,13)/t5-,6+,7+,8-,9+,10+/m1/s1
InChIKey PPOMAEHTEKOIJZ-NESWFBESSA-N
Mol Weight 231.25 g/mol
Molecular Formula C10H17NO5
Exact Mass 231.110673 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 7kLbUggAY5P
Name (1-R,2-R,3-S,4-S,5-S,6-S)-5-ACETAMIDO-1-(HYDROXYMETHYL)-BICYCLO-[4.1.0]-2,3,4-HEPTANETRIOL
Compound Number 14
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C10H17NO5
InChI InChI=1S/C10H17NO5/c1-4(13)11-6-5-2-10(5,3-12)9(16)8(15)7(6)14/h5-9,12,14-16H,2-3H2,1H3,(H,11,13)/t5-,6+,7+,8-,9+,10+/m1/s1
InChIKey PPOMAEHTEKOIJZ-NESWFBESSA-N
Literature Reference Author K.S.E.TANAKA,G.C.WINTERS,R.J.BATCHELOR,F.W.B.EINSTEIN,A.J.BE NNET
Literature Reference Citation J.AM.CHEM.SOC.,123,998(2001)
Literature Reference DOI 10.1021/ja005746b
Molecular Weight 231.249 g/mol
Solvent D2O
Source File Reference UWMZ18854