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4H-1,12-Methano-6H-[1,7]dioxacyclododecino[4,3-b]pyrrole-6,10(7H)-dione, 2,3,3a,8,9,12,13,13a-octahydro-7,9-dimethyl-, [3aR-(3aR*,7R*,9S*,12R*,13aR*)]-
SpectraBase Compound ID Am7L9y7RV2g
InChI InChI=1S/C15H23NO4/c1-9-5-10(2)15(18)20-12-6-13-11(8-19-14(9)17)3-4-16(13)7-12/h9-13H,3-8H2,1-2H3/t9?,10?,11-,12+,13+/m0/s1
InChIKey ZDMOQFBTNLNLMR-FQLQODGNSA-N
Mol Weight 281.35 g/mol
Molecular Formula C15H23NO4
Exact Mass 281.162708 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7uXwKqvbvJd
Name 4H-1,12-Methano-6H-[1,7]dioxacyclododecino[4,3-b]pyrrole-6,10(7H)-dione, 2,3,3a,8,9,12,13,13a-octahydro-7,9-dimethyl-, [3aR-(3aR*,7R*,9S*,12R*,13aR*)]-
CAS Registry Number 125133-92-8
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H23NO4
InChI InChI=1S/C15H23NO4/c1-9-5-10(2)15(18)20-12-6-13-11(8-19-14(9)17)3-4-16(13)7-12/h9-13H,3-8H2,1-2H3/t9?,10?,11-,12+,13+/m0/s1
InChIKey ZDMOQFBTNLNLMR-FQLQODGNSA-N
Molecular Weight 281.352 g/mol
SMILES [C@@]12(N3CC[C@]1(COC(C(CC(C(O[C@](C2)(C3)[H])=O)C)C)=O)[H])[H]
SPLASH splash10-00di-0910000000-b385a737971da9f580f7
Source of Spectrum KC-1989-1342-14
Synonyms (-)-(1R,6R,8R)-6,9-O,O-(meso-2,4-dimethylglutaryl)-6-hydroxy-1-hydroxymethylpyrrolizidine (4R,13R,15R)-8,10-dimethyl-6,12-dioxa-1-azatricyclo[11.2.1.0(4,15)]hexadecane-7,11-dione
Wiley ID 1284870