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[1R*-(1.alpha.,3a.beta,6a.beta.)]-1-ethyl-1-hydroxy-6a-nitrooctahydropentalen-2-one
SpectraBase Compound ID 6jq9s4q0NEB
InChI InChI=1S/C10H15NO4/c1-2-10(13)8(12)6-7-4-3-5-9(7,10)11(14)15/h7,13H,2-6H2,1H3/t7-,9+,10-/m0/s1
InChIKey RROPCBJKQRITPG-SFGNSQDASA-N
Mol Weight 213.23 g/mol
Molecular Formula C10H15NO4
Exact Mass 213.100108 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JSNy9DaOspe
Name [1R*-(1.alpha.,3a.beta,6a.beta.)]-1-ethyl-1-hydroxy-6a-nitrooctahydropentalen-2-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H15NO4
InChI InChI=1S/C10H15NO4/c1-2-10(13)8(12)6-7-4-3-5-9(7,10)11(14)15/h7,13H,2-6H2,1H3/t7-,9+,10-/m0/s1
InChIKey RROPCBJKQRITPG-SFGNSQDASA-N
Molecular Weight 213.233 g/mol
SMILES O[C@@]1([C@]2(N(=O)=O)[C@](CC1=O)(CCC2)[H])CC
SPLASH splash10-0a6r-9600000000-5a62e496323b220b35e4
Source of Spectrum KC-1991-1650-18
Synonyms (1R,3aS,6aR)-1-ethyl-1-hydroxy-6a-nitrohexahydro-2(1H)-pentalenone
Wiley ID 1212488