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3-cyclohexyl-8-phenyl-1,6,8-triazabicyclo[4.3.0]non-3-ene-7,9-dione
SpectraBase Compound ID FnoxcEPYTJe
InChI InChI=1S/C18H21N3O2/c22-17-19-12-11-15(14-7-3-1-4-8-14)13-20(19)18(23)21(17)16-9-5-2-6-10-16/h2,5-6,9-11,14H,1,3-4,7-8,12-13H2
InChIKey MVTRQXNESKIJNR-UHFFFAOYSA-N
Mol Weight 311.39 g/mol
Molecular Formula C18H21N3O2
Exact Mass 311.163377 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JnW08q9YFsS
Name 3-cyclohexyl-8-phenyl-1,6,8-triazabicyclo[4.3.0]non-3-ene-7,9-dione
Alternate Name(s) 6-cyclohexyl-2-phenyl-5,8-dihydro-1H-[1,2,4]triazolo[1,2-a]pyridazine-1,3(2H)-dione
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H21N3O2
InChI InChI=1S/C18H21N3O2/c22-17-19-12-11-15(14-7-3-1-4-8-14)13-20(19)18(23)21(17)16-9-5-2-6-10-16/h2,5-6,9-11,14H,1,3-4,7-8,12-13H2
InChIKey MVTRQXNESKIJNR-UHFFFAOYSA-N
Molecular Weight 311.385 g/mol
SMILES C1(N(C(N2CC=C(CN12)C1CCCCC1)=O)c1ccccc1)=O
SPLASH splash10-016r-5942000000-c5521ac11f87e6b427b1
Source of Spectrum KC-1991-1897-12
Wiley ID 1312532