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10-Cyano-9-hydroxy-1-azatricyclo[7.3.0.0(3,8)]dodeca-3,4,6-trien-2-one isomer
SpectraBase Compound ID 6yLhgcIQJ9Q
InChI InChI=1S/C12H10N2O2/c13-7-8-5-6-14-11(15)9-3-1-2-4-10(9)12(8,14)16/h1-2,4,8,10,16H,5-6H2/t8-,10?,12+/m1/s1
InChIKey IGZQBRHRHHALHW-ZBIPGQCISA-N
Mol Weight 214.22 g/mol
Molecular Formula C12H10N2O2
Exact Mass 214.074228 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4qmTEsYcls
Name 10-Cyano-9-hydroxy-1-azatricyclo[7.3.0.0(3,8)]dodeca-3,4,6-trien-2-one isomer
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H10N2O2
InChI InChI=1S/C12H10N2O2/c13-7-8-5-6-14-11(15)9-3-1-2-4-10(9)12(8,14)16/h1-2,4,8,10,16H,5-6H2/t8-,10?,12+/m1/s1
InChIKey IGZQBRHRHHALHW-ZBIPGQCISA-N
Molecular Weight 214.224 g/mol
SMILES O[C@@]12N(C(C3=C=CC=CC23)=O)CC[C@@]1(C#N)[H]
SPLASH splash10-01ot-0900000000-c83107f2bb377c8a095b
Source of Spectrum C-117-2708-41
Synonyms (9S,10R)10-Cyano-9-hydroxy-1-azatricyclo[7.3.0.0(3,8)]dodeca-3,4,6-trien-2-one isomer
Wiley ID 758730