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REL-(1R,5AR,7S,7AR,7BR)-1,7-DIHYDROXY-6-OXAOCTAHYDRO-2H-CYCLOPENTA-[GH]-PYRROLIZIN-2-ONE
SpectraBase Compound ID HJZTjTCxSgV
InChI InChI=1S/C8H11NO4/c10-6-4-5-3(13-8(4)12)1-2-9(5)7(6)11/h3-6,8,10,12H,1-2H2/t3-,4+,5-,6+,8-/m0/s1
InChIKey QHJDXFDMYJJOJT-ZWGHOWJVSA-N
Mol Weight 185.18 g/mol
Molecular Formula C8H11NO4
Exact Mass 185.068808 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 73Dmx4my9RM
Name REL-(1R,5AR,7S,7AR,7BR)-1,7-DIHYDROXY-6-OXAOCTAHYDRO-2H-CYCLOPENTA-[GH]-PYRROLIZIN-2-ONE
Compound Number 26
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C8H11NO4
InChI InChI=1S/C8H11NO4/c10-6-4-5-3(13-8(4)12)1-2-9(5)7(6)11/h3-6,8,10,12H,1-2H2/t3-,4+,5-,6+,8-/m0/s1
InChIKey QHJDXFDMYJJOJT-ZWGHOWJVSA-N
Literature Reference Author S.E.DENMARK,A.THORARENSEN,D.S.MIDDLETON
Literature Reference Citation J.AM.CHEM.SOC.,118,8266(1996)
Literature Reference DOI 10.1021/ja961630x
Molecular Weight 185.180 g/mol
Sample ID 45904
Solvent DMSO-D6