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(5R,8S,10S,11R)-5,8-Dihydro-10,11-dihydroxy-2-phenyl-5,8-ethano-1H-[1,2,4]-triazolo[1,2-a]pyridazine-1,3(2H)-dione
SpectraBase Compound ID 5NTXPTNkpHv
InChI InChI=1S/C14H13N3O4/c18-11-9-6-7-10(12(11)19)17-14(21)15(13(20)16(9)17)8-4-2-1-3-5-8/h1-7,9-12,18-19H/t9-,10+,11-,12+
InChIKey QDBTVSNHGUIRSO-BKUVIOGVSA-N
Mol Weight 287.27 g/mol
Molecular Formula C14H13N3O4
Exact Mass 287.090606 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EFdA22uUdxl
Name (5R,8S,10S,11R)-5,8-Dihydro-10,11-dihydroxy-2-phenyl-5,8-ethano-1H-[1,2,4]-triazolo[1,2-a]pyridazine-1,3(2H)-dione
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Formula C14H13N3O4
InChI InChI=1S/C14H13N3O4/c18-11-9-6-7-10(12(11)19)17-14(21)15(13(20)16(9)17)8-4-2-1-3-5-8/h1-7,9-12,18-19H/t9-,10+,11-,12+
InChIKey QDBTVSNHGUIRSO-BKUVIOGVSA-N
Molecular Weight 287.275 g/mol
SMILES O[C@@]1([C@@]([C@@]2(N3N([C@]1(C=C2)[H])C(N(C3=O)c1ccccc1)=O)[H])(O)[H])[H]
SPLASH splash10-003r-9380000000-7d3997a9baec2650aa03
Source of Spectrum F5-4-3846-38
Synonyms (5R,8S,10S,11R)-10,11-dihydroxy-2-phenyl-5,8-dihydro-1H-5,8-ethano[1,2,4]triazolo[1,2-a]pyridazine-1,3(2H)-dione
Wiley ID 1733037