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5-PHENYL-3,5,7-TRIAZATRICYCLO-[6.5.1.0(3,7)]-TETRADECA-9,11,13-TRIENE-4,6-DIONE
SpectraBase Compound ID 83lWskllMDn
InChI InChI=1S/C17H15N3O2/c21-16-18-12-13-7-3-1-6-10-15(11-13)20(18)17(22)19(16)14-8-4-2-5-9-14/h1-10,15H,11-12H2/b3-1-,10-6-,13-7+
InChIKey MPWIEERXPKSOAU-KXSJSXNZSA-N
Mol Weight 293.33 g/mol
Molecular Formula C17H15N3O2
Exact Mass 293.116427 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9pzFz618qEz
Name 5,11-Methano-1H-[1,2,4]triazolo[1,2-a][1,2]diazecine-1,3(2H)-dione, 5,12-dihydro-2-phenyl-, (.+-.)-
CAS Registry Number 128643-46-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H15N3O2
InChI InChI=1S/C17H15N3O2/c21-16-18-12-13-7-3-1-6-10-15(11-13)20(18)17(22)19(16)14-8-4-2-5-9-14/h1-10,15H,11-12H2/b3-1-,10-6-,13-7+
InChIKey MPWIEERXPKSOAU-KXSJSXNZSA-N
Molecular Weight 293.326 g/mol
SMILES C1(N(C(N2C3\C=C/C=C\C=C\(CN12)C3)=O)c1ccccc1)=O
SPLASH splash10-014l-6910000000-ac6ea89aac06a1b55486
Source of Spectrum B-43-478-24
Synonyms 4-Phenyl-2,4,6-triazatricyclo[6.5.1.0(2,6)]tetradeca-8,10,12-triene-3,5-dione 5-Phenyl-3,5,7-triazatricyclo[6.5.1.0(3,7)]tetradeca-9,11,13-triene-4,6-dione
Wiley ID 1296379