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(+-)-phakelline
SpectraBase Compound ID K0m3jTFD122
InChI InChI=1S/C11H13N5O/c12-10-13-9-11(14-10)4-2-6-16(11)8(17)7-3-1-5-15(7)9/h1,3,5,9H,2,4,6H2,(H3,12,13,14)/t9-,11+/m1/s1
InChIKey DBYKPFUBHBFDQT-KOLCDFICSA-N
Mol Weight 231.26 g/mol
Molecular Formula C11H13N5O
Exact Mass 231.11201 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3l4QtRbp3Gp
Name (+-)-phakelline
CAS Registry Number 101541-45-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H13N5O
InChI InChI=1S/C11H13N5O/c12-10-13-9-11(14-10)4-2-6-16(11)8(17)7-3-1-5-15(7)9/h1,3,5,9H,2,4,6H2,(H3,12,13,14)/t9-,11+/m1/s1
InChIKey DBYKPFUBHBFDQT-KOLCDFICSA-N
Molecular Weight 231.259 g/mol
SMILES N1C(=N[C@@]23[C@]1([n]1cccc1C(N3CCC2)=O)[H])N
SPLASH splash10-0002-9110000000-c9b549c19bd549cb44fd
Source of Spectrum F-41-6031-7
Synonyms (3aS,12aR)-2-amino-1,5,6,12a-tetrahydro-4H,8H-imidazo[4,5-b]dipyrrolo[1,2-a:1,2-d]pyrazin-8-one
Wiley ID 1232612