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1-(2-Fluoroethyl)-1,5,6,7,8,8a-hexahydro-6,7,8-trihydroxy-3H-oxazolo[3,4-a]pyridin-3-one
SpectraBase Compound ID 36WZRcj15FO
InChI InChI=1S/C9H14FNO5/c10-2-1-5-6-8(14)7(13)4(12)3-11(6)9(15)16-5/h4-8,12-14H,1-3H2/t4-,5-,6+,7-,8+/m1/s1
InChIKey ACCAFODTYQIUJC-CBQIKETKSA-N
Mol Weight 235.21 g/mol
Molecular Formula C9H14FNO5
Exact Mass 235.085601 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID D1Jsjkj6XzO
Name 1-(2-Fluoroethyl)-1,5,6,7,8,8a-hexahydro-6,7,8-trihydroxy-3H-oxazolo[3,4-a]pyridin-3-one
Alternate Name(s) (1R,6R,7R,8S,8aR)-1-(2-Fluoroethyl)-1,5,6,7,8,8a-hexahydro-6,7,8-trihydroxy-3H-oxazolo[3,4-a]pyridin-3-one 1-(2-fluoroethyl)-6,7,8-trihydroxyhexahydro[1,3]oxazolo[3,4-a]pyridin-3-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H14FNO5
InChI InChI=1S/C9H14FNO5/c10-2-1-5-6-8(14)7(13)4(12)3-11(6)9(15)16-5/h4-8,12-14H,1-3H2/t4-,5-,6+,7-,8+/m1/s1
InChIKey ACCAFODTYQIUJC-CBQIKETKSA-N
Molecular Weight 235.211 g/mol
SMILES O[C@@]1([C@@]([C@@](CN2[C@]1([C@](OC2=O)(CCF)[H])[H])(O)[H])(O)[H])[H]
SPLASH splash10-0udi-0900000000-e8cf4101d9b4cc9eeb68
Source of Spectrum AT-37-8576-8
Wiley ID 853674