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4H-1,11-Methano[1,6]dioxacycloundecino[9,8-b]pyrrole-6,9-dione, 2,3,3a,7,8,11,12,12a-octahydro-, [3aR-(3aR*,11R*,12aR*)]-
SpectraBase Compound ID A98fUicITQb
InChI InChI=1S/C12H17NO4/c14-11-1-2-12(15)17-9-5-10-8(7-16-11)3-4-13(10)6-9/h8-10H,1-7H2/t8-,9+,10+/m0/s1
InChIKey UTYNMQLERZXVIG-IVZWLZJFSA-N
Mol Weight 239.27 g/mol
Molecular Formula C12H17NO4
Exact Mass 239.115758 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FGaBh8AsMt6
Name 4H-1,11-Methano[1,6]dioxacycloundecino[9,8-b]pyrrole-6,9-dione, 2,3,3a,7,8,11,12,12a-octahydro-, [3aR-(3aR*,11R*,12aR*)]-
Alternate Name(s) (+)-(1R,6R,8R)-6,9-O,O-(succinyl)-6-hydroxy-1-hydroxy-methylpyrrolizidine (4R,12R,14R)-6,11-dioxa-1-azatricyclo[10.2.1.0(4,14)]pentadecane-7,10-dione
CAS Registry Number 125038-89-3
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H17NO4
InChI InChI=1S/C12H17NO4/c14-11-1-2-12(15)17-9-5-10-8(7-16-11)3-4-13(10)6-9/h8-10H,1-7H2/t8-,9+,10+/m0/s1
InChIKey UTYNMQLERZXVIG-IVZWLZJFSA-N
Molecular Weight 239.271 g/mol
SMILES [C@@]12(N3CC[C@]1(COC(CCC(O[C@](C2)(C3)[H])=O)=O)[H])[H]
SPLASH splash10-00di-0920000000-3f711ad106014b9ac8ec
Source of Spectrum KC-1989-1342-15
Wiley ID 1241842