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2-BENZOYLOXY-3-O-ACETYL-4-HYDROXYMETHYL-5-(TOSYLAMINO)-CYCLOPENTANOL
SpectraBase Compound ID Bzehklgp0CT
InChI InChI=1S/C22H25NO8S/c1-13-8-10-16(11-9-13)32(28,29)23-18-17(12-24)20(30-14(2)25)21(19(18)26)31-22(27)15-6-4-3-5-7-15/h3-11,17-21,23-24,26H,12H2,1-2H3/t17-,18-,19-,20+,21+/m1/s1
InChIKey VQZKXZLDQPOXGS-XKRYSZRTSA-N
Mol Weight 463.5 g/mol
Molecular Formula C22H25NO8S
Exact Mass 463.130088 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 4ZkqdMHKpTB
Name 2-BENZOYLOXY-3-O-ACETYL-4-HYDROXYMETHYL-5-(TOSYLAMINO)-CYCLOPENTANOL
Compound Number 25
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C22H25NO8S
InChI InChI=1S/C22H25NO8S/c1-13-8-10-16(11-9-13)32(28,29)23-18-17(12-24)20(30-14(2)25)21(19(18)26)31-22(27)15-6-4-3-5-7-15/h3-11,17-21,23-24,26H,12H2,1-2H3/t17-,18-,19-,20+,21+/m1/s1
InChIKey VQZKXZLDQPOXGS-XKRYSZRTSA-N
Literature Reference Author R.BLATTNER,R.H.FURNEAUX,T.KEMMITT,P.C.TYLER,R.J.FERRIER,A.K. TIDEN
Literature Reference Citation J.CHEM.SOC.PERKIN-1,3411(1994)
Literature Reference DOI 10.1039/p19940003411
Molecular Weight 463.502 g/mol
Solvent CDCl3
Source File Reference UWRU4409